data_2n8e_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 2n8e _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' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.438 -1.073 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -50.43 128.66 20.4 Favored 'General case' 0 C--O 1.254 1.304 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt . . . . . 0 C--O 1.236 0.388 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -164.876 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.464 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 4.1 p-10 . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -91.24 -177.28 4.83 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.816 -1.083 . . . . 0.0 108.527 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.12 135.77 33.17 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.504 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 25.2 p -116.07 138.07 51.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.804 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -131.67 169.27 16.4 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -56.23 -47.02 79.31 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.448 0.468 . . . . 0.0 112.08 -177.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -102.41 12.02 37.15 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.091 0.472 . . . . 0.0 110.626 -173.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.26 99.86 9.23 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.59 101.89 11.01 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-O 121.347 0.594 . . . . 0.0 110.146 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.14 -52.8 1.04 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.462 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.402 ' O ' ' HD2' ' A' ' 18' ' ' ARG . 47.0 m -70.16 115.95 9.95 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -177.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 73.4 m -59.36 -28.47 66.89 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -177.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.4 t -72.6 -35.98 68.0 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.248 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' A' ' 15' ' ' CYS . 6.8 mpt_? 59.84 18.32 7.29 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.853 0.861 . . . . 0.0 111.086 -172.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -88.34 112.75 23.22 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.3 m -114.18 151.8 32.16 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 120.849 0.356 . . . . 0.0 111.054 -177.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 p30 -108.9 -176.56 3.07 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.18 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -60.37 -12.06 8.3 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 125.678 1.591 . . . . 0.0 114.119 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -104.17 7.07 36.09 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.3 m120 64.99 26.66 12.71 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.455 1.102 . . . . 0.0 110.269 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -103.83 153.43 20.75 Favored 'General case' 0 N--CA 1.42 -1.953 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.15 176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.5 m -79.93 145.01 32.86 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.19 164.99 23.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.5 175.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.59 131.15 84.75 Favored Pre-proline 0 C--N 1.309 -1.178 0 O-C-N 123.752 0.657 . . . . 0.0 110.597 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.88 178.68 7.12 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.489 2.126 . . . . 0.0 110.26 176.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.91 -23.38 41.85 Favored 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.5 m -64.45 -34.69 78.78 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.592 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.53 -148.61 18.71 Favored Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.601 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.2 60.82 0.6 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.001 0 C-N-CA 121.274 -0.489 . . . . 0.0 112.443 -178.655 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.6 t . . . . . 0 C--O 1.244 0.77 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.8 ttp180 -66.33 149.16 50.79 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.453 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.5 pt . . . . . 0 C--N 1.35 0.59 0 C-N-CA 124.607 1.163 . . . . 0.0 113.9 -175.285 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 . . . . . 0 CA--C 1.498 -1.03 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.669 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 15.5 mm100 -89.28 167.95 12.65 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.801 -178.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.517 ' O ' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.51 148.18 22.9 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.638 174.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.4 p -137.83 133.52 34.05 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.245 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -137.32 177.16 8.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -71.58 -49.68 38.22 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.984 0.421 . . . . 0.0 110.493 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -88.04 -24.12 23.57 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.428 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.9 86.71 2.64 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -91.06 110.64 21.91 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.677 -176.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -112.72 -52.46 2.78 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' HB2' ' A' ' 6' ' ' GLN . 69.4 m -86.96 133.63 33.57 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.926 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -25.78 67.8 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.039 0.935 . . . . 0.0 112.138 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 p -78.16 -35.88 48.31 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.046 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 62.03 18.78 10.24 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.19 0.996 . . . . 0.0 110.814 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -86.33 101.39 13.05 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.6 m -108.53 145.65 34.45 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.945 -173.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 p30 -93.0 -178.07 4.69 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.562 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -67.71 -2.65 7.33 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.502 0.721 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -106.34 5.04 29.25 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 120.774 0.321 . . . . 0.0 110.222 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 65.88 24.15 11.29 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.873 0.869 . . . . 0.0 111.156 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -107.2 154.4 21.28 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.3 m -73.89 149.32 41.56 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.8 m -123.05 175.92 5.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.091 174.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.429 HD11 ' HD2' ' A' ' 29' ' ' PRO . 48.0 tp -57.71 119.87 36.89 Favored Pre-proline 0 C--N 1.323 -0.563 0 O-C-N 124.175 0.922 . . . . 0.0 111.391 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.429 ' HD2' HD11 ' A' ' 28' ' ' LEU . 63.2 Cg_endo -74.26 171.27 18.37 Favored 'Trans proline' 0 C--O 1.251 1.153 0 C-N-CA 122.721 2.281 . . . . 0.0 110.691 177.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -69.02 -15.95 63.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.078 0.466 . . . . 0.0 110.178 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.7 m 81.46 112.11 0.06 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.369 1.467 . . . . 0.0 111.941 176.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.27 67.49 0.43 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.47 -65.32 0.89 Allowed Glycine 0 C--N 1.308 -1.021 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.437 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.244 0.807 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -42.91 122.98 2.58 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 124.635 1.174 . . . . 0.0 111.943 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.5 pt . . . . . 0 C--N 1.318 -0.795 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.942 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.4 t30 . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 122.06 0.933 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -78.91 136.15 37.19 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 172.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -82.55 141.52 32.55 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.554 -1.258 . . . . 0.0 111.032 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.0 p -125.31 149.46 48.06 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -125.97 177.07 6.55 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -58.16 -41.62 84.2 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -174.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -110.0 13.12 23.47 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.223 0.535 . . . . 0.0 110.634 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.7 mp -120.33 102.49 8.51 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.842 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -125.98 117.61 23.64 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.697 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -132.46 22.6 4.36 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 106.457 -1.682 . . . . 0.0 106.457 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.4 m -100.45 147.16 26.17 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.482 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.5 m -81.46 -37.89 27.26 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -80.64 -24.89 38.69 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.296 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.4 mtm-85 56.04 28.29 12.6 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.07 0.948 . . . . 0.0 110.943 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -109.66 125.35 52.51 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.515 -176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.1 m -117.88 139.19 51.47 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 p30 -89.43 -174.83 4.51 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 120.834 0.349 . . . . 0.0 110.907 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.4 ptt180 -62.86 -4.87 2.37 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.363 1.465 . . . . 0.0 114.033 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.96 16.3 15.12 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.157 -0.34 . . . . 0.0 110.552 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.8 19.14 11.31 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.204 0.526 . . . . 0.0 111.007 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -92.07 135.31 34.07 Favored 'General case' 0 N--CA 1.428 -1.567 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.0 t -70.93 134.16 47.0 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.8 m -119.65 150.28 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.33 143.45 69.03 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.224 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -56.36 110.33 0.56 Allowed 'Trans proline' 0 C--O 1.243 0.728 0 C-N-CA 122.33 2.02 . . . . 0.0 110.397 174.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.54 -26.47 30.09 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 -175.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.3 m -81.48 -21.27 38.83 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 121.455 0.645 . . . . 0.0 109.678 -177.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.63 135.21 1.87 Allowed Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.704 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 122.96 2.29 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 119.937 -1.125 . . . . 0.0 112.775 177.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.388 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 177.816 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.915 0 CA-C-O 122.54 1.162 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -103.04 123.35 46.47 Favored 'General case' 0 C--N 1.275 -2.654 0 CA-C-N 112.709 -2.042 . . . . 0.0 105.558 177.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt . . . . . 0 C--O 1.245 0.847 0 O-C-N 123.648 0.592 . . . . 0.0 111.112 -179.175 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 CA--C 1.508 -0.648 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -97.59 162.34 13.34 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.504 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -84.38 132.68 34.56 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.684 0.615 . . . . 0.0 110.488 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -138.29 145.0 40.71 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-O 121.755 0.788 . . . . 0.0 110.661 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.67 -164.96 1.28 Allowed 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -72.33 -46.41 55.72 Favored 'General case' 0 N--CA 1.42 -1.931 0 CA-C-O 120.754 0.311 . . . . 0.0 111.157 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -105.28 -7.22 19.06 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 120.976 0.417 . . . . 0.0 112.098 -176.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mp -114.89 93.81 4.48 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -153.89 138.3 16.73 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -133.76 -0.15 3.18 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.812 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -70.11 131.59 44.52 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.219 -0.301 . . . . 0.0 110.533 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.8 m -58.63 -32.2 68.82 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.462 0.649 . . . . 0.0 110.032 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.25 -36.21 79.38 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.76 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.17 26.51 10.37 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.598 1.159 . . . . 0.0 111.745 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.415 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 59.1 tttp -126.34 132.19 51.64 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.1 m -119.96 142.8 48.43 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.203 0.314 . . . . 0.0 110.545 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -90.38 -179.19 5.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -58.47 -29.33 66.12 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -88.53 13.59 11.7 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.706 0.288 . . . . 0.0 111.292 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 m120 64.86 29.81 12.37 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -109.43 147.94 31.99 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.652 -0.819 . . . . 0.0 109.112 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 19' ' ' LYS . 59.7 m -62.7 142.59 58.05 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 124.07 0.856 . . . . 0.0 110.848 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.9 168.78 21.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -88.77 122.93 68.8 Favored Pre-proline 0 C--N 1.312 -1.037 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -81.65 -166.64 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.52 2.814 . . . . 0.0 110.236 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 mp0 -76.31 -33.19 59.04 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.9 p -77.75 -16.76 58.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.273 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.11 -147.16 23.4 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.335 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 115.89 54.1 0.36 Allowed Glycine 0 C--N 1.301 -1.389 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 C-N-CA 121.578 -0.344 . . . . 0.0 113.566 -176.391 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -57.79 141.34 49.21 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--N 1.307 -1.261 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.879 -176.98 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 t30 . . . . . 0 N--CA 1.485 1.299 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.96 145.02 52.03 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -77.45 139.46 39.66 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 p -119.95 133.81 55.44 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -125.33 143.03 51.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 121.254 0.549 . . . . 0.0 111.869 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.419 ' HG3' ' ND1' ' A' ' 11' ' ' HIS . 11.8 pt20 -61.85 -16.18 48.12 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.317 1.047 . . . . 0.0 113.797 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.419 ' ND1' ' HG3' ' A' ' 10' ' ' GLN . 76.1 m80 -112.5 13.72 20.16 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.023 -0.423 . . . . 0.0 111.938 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -121.82 165.19 16.25 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -115.0 30.66 7.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.649 0.738 . . . . 0.0 109.194 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -48.44 -52.53 21.69 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.019 1.328 . . . . 0.0 112.858 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.415 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 74.7 m -108.63 152.36 24.9 Favored 'General case' 0 C--N 1.278 -2.514 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.146 176.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -59.55 -45.63 91.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 t -108.37 -15.72 14.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.831 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.415 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 82.8 mtm180 49.35 51.01 17.13 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.505 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.45 100.82 4.61 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.7 m -96.55 130.43 43.73 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.02 -173.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.412 HD22 ' HB2' ' A' ' 25' ' ' LYS . 34.8 p30 -80.27 -175.87 5.32 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.465 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -67.51 -2.95 7.32 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -115.52 12.65 16.23 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.3 m120 63.66 23.57 13.58 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.944 0.878 . . . . 0.0 110.93 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HB2' HD22 ' A' ' 21' ' ' ASN . 98.4 mttt -96.91 146.12 25.25 Favored 'General case' 0 N--CA 1.411 -2.375 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.129 174.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.3 t -84.71 143.52 29.13 Favored 'General case' 0 C--N 1.256 -3.488 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.448 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 m -125.25 136.48 60.71 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.075 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -55.9 147.33 43.83 Favored Pre-proline 0 C--O 1.244 0.777 0 O-C-N 123.656 0.598 . . . . 0.0 112.169 -174.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.87 136.63 43.54 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.257 2.638 . . . . 0.0 111.349 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -70.25 -9.89 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 p -77.47 -30.3 53.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 121.326 0.584 . . . . 0.0 110.017 172.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.67 168.15 31.04 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.575 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.57 173.86 13.18 Favored Glycine 0 N--CA 1.427 -1.915 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.147 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.108 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 178.401 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.484 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 tpp180 -67.03 127.93 34.45 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 173.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 pt . . . . . 0 C--N 1.311 -1.104 0 O-C-N 123.951 0.782 . . . . 0.0 111.659 -178.69 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 . . . . . 0 N--CA 1.486 1.331 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -79.63 151.88 30.32 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.496 ' HZ2' ' HB3' ' A' ' 7' ' ' LYS . 5.1 mmmp? -74.46 130.55 39.83 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.069 0.461 . . . . 0.0 112.098 177.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.54 159.04 20.85 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 175.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -146.0 163.48 35.06 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 -177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -75.44 -15.74 60.4 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.162 0.506 . . . . 0.0 112.216 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -101.56 12.13 37.78 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.691 0.757 . . . . 0.0 110.091 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.9 tp -120.03 149.61 41.88 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.23 19.44 2.77 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.509 -1.276 . . . . 0.0 112.369 -174.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 2' ' ' ARG . 7.9 m-20 -67.71 -17.07 64.44 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.0 m -85.76 110.36 19.29 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.5 m -53.33 -44.78 68.73 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.6 t -102.56 9.88 39.16 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.475 0.655 . . . . 0.0 110.139 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.496 ' HD2' ' N ' ' A' ' 18' ' ' ARG . 4.5 mpt_? 59.08 31.25 21.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.104 0.962 . . . . 0.0 111.63 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.45 120.14 25.09 Favored 'General case' 0 CA--C 1.501 -0.927 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.254 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.5 m -131.02 148.93 52.81 Favored 'General case' 0 C--N 1.275 -2.67 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.594 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -88.41 176.92 6.98 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -66.39 -15.14 63.07 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -95.89 6.19 49.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 120.734 0.302 . . . . 0.0 111.122 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 71.69 32.66 1.93 Allowed 'General case' 0 C--O 1.26 1.619 0 C-N-CA 123.877 0.871 . . . . 0.0 112.185 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.82 149.25 25.22 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 172.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 21.2 t -78.93 135.15 36.88 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 m -118.21 145.28 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 CA-C-O 120.958 0.408 . . . . 0.0 110.436 177.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.404 HD11 ' HD2' ' A' ' 29' ' ' PRO . 29.2 tp -67.82 127.28 93.35 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.921 -171.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.404 ' HD2' HD11 ' A' ' 28' ' ' LEU . 78.3 Cg_endo -82.83 175.87 8.24 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.773 2.315 . . . . 0.0 111.42 175.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -92.12 -48.26 6.81 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.154 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.7 m -59.94 -48.32 82.17 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -115.52 149.59 18.82 Favored Glycine 0 N--CA 1.434 -1.44 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.549 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.24 -27.78 5.18 Favored Glycine 0 C--N 1.306 -1.092 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.774 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 CA-C-O 121.505 0.503 . . . . 0.0 111.986 -178.018 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 122.309 1.052 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.485 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 17.6 tpp180 -100.01 139.19 36.04 Favored 'General case' 0 C--N 1.273 -2.755 0 CA-C-N 113.823 -1.535 . . . . 0.0 106.914 168.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.8 pt . . . . . 0 C--O 1.246 0.909 0 O-C-N 123.267 0.354 . . . . 0.0 110.701 177.663 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -84.06 158.38 21.46 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -80.74 126.08 30.86 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 120.736 0.303 . . . . 0.0 110.46 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 p -131.12 138.59 49.58 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -129.95 175.77 8.6 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -64.16 -19.93 65.65 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -118.22 13.47 13.74 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.399 0.619 . . . . 0.0 110.045 175.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -135.21 35.07 3.03 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.473 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 11.1 m-20 -79.44 87.59 5.06 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.802 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -87.78 -12.71 44.29 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.797 0.808 . . . . 0.0 109.814 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.485 ' SG ' ' HB3' ' A' ' 2' ' ' ARG . 29.7 m -81.16 118.22 22.37 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 173.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.6 m -63.86 -32.84 74.49 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -169.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -81.86 -7.94 59.64 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.592 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.473 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 77.6 mtp180 57.52 28.54 15.7 Favored 'General case' 0 C--N 1.358 0.936 0 C-N-CA 124.877 1.271 . . . . 0.0 111.413 -176.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.6 tttm -83.16 100.53 10.61 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -128.1 144.79 51.13 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.651 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -89.39 -179.1 5.76 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 120.964 0.412 . . . . 0.0 111.301 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -63.47 -18.07 63.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -93.58 5.24 52.27 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.134 0.492 . . . . 0.0 109.717 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 68.52 24.39 7.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.306 1.043 . . . . 0.0 110.882 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -97.11 135.83 38.52 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.3 t -68.05 135.98 53.1 Favored 'General case' 0 C--N 1.287 -2.145 0 O-C-N 123.559 0.537 . . . . 0.0 109.653 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.2 m -117.62 143.03 29.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 CA-C-O 120.601 0.239 . . . . 0.0 110.544 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.4 tp -67.48 125.51 91.27 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.845 -172.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -69.11 107.87 1.83 Allowed 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.672 2.248 . . . . 0.0 108.72 170.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -15.62 62.2 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.252 0.549 . . . . 0.0 112.056 -174.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -112.51 9.52 19.56 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.037 0.922 . . . . 0.0 108.936 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -145.23 -133.54 2.61 Favored Glycine 0 N--CA 1.435 -1.37 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -157.89 152.14 23.34 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.489 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.034 -178.132 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.417 ' HB2' ' HG ' ' A' ' 28' ' ' LEU . 33.6 m . . . . . 0 N--CA 1.443 -0.812 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -62.11 136.28 57.88 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 pt . . . . . 0 C--O 1.254 1.342 0 O-C-N 123.753 0.658 . . . . 0.0 111.941 178.764 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 120.704 0.288 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -76.09 164.65 25.91 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 27.6 mtpp -78.38 171.23 15.39 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.137 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -117.83 133.46 55.91 Favored 'General case' 0 C--N 1.285 -2.225 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -125.53 160.55 29.26 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -62.14 -25.57 67.82 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 123.489 0.716 . . . . 0.0 112.462 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -101.92 6.23 41.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.702 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.7 tp -97.65 95.16 7.4 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.236 0.541 . . . . 0.0 110.175 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -97.02 10.89 37.98 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.539 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -78.41 -23.79 46.55 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.448 1.118 . . . . 0.0 108.443 178.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.1 m -79.88 107.49 12.7 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 170.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.3 m -52.31 -47.09 66.14 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.716 0.635 . . . . 0.0 112.665 -169.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.7 m -98.85 4.83 47.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.771 -177.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 53.37 30.78 10.82 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.449 0.7 . . . . 0.0 110.358 -175.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -83.26 130.72 35.09 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.112 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 63.7 m -120.17 151.68 38.76 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.217 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.89 -176.16 3.17 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -62.61 -11.92 19.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.9 12.03 29.29 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 121.888 -0.507 . . . . 0.0 110.745 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 66.28 25.13 10.56 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 122.136 0.969 . . . . 0.0 108.95 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 68.3 mttm -93.81 160.4 14.76 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.572 176.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -84.67 143.93 28.9 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.0 m -140.22 154.2 22.77 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 CA-C-O 120.97 0.414 . . . . 0.0 110.036 175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 1' ' ' CYS . 7.8 mp -90.29 154.73 46.85 Favored Pre-proline 0 C--N 1.305 -1.365 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.06 179.95 5.26 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 122.291 1.994 . . . . 0.0 111.01 174.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.56 -32.16 73.08 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 122.79 0.436 . . . . 0.0 111.412 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.9 p -83.58 2.73 35.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.59 -113.29 4.17 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.366 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.14 170.9 29.69 Favored Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.304 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 179.335 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.955 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -46.87 123.59 5.34 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.552 1.141 . . . . 0.0 110.612 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt . . . . . 0 C--N 1.321 -0.642 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -174.927 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 C--O 1.234 0.248 0 CA-C-O 122.238 1.018 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -83.83 168.34 16.22 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.309 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -86.83 132.37 33.85 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.654 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 27.7 p -115.0 141.55 47.84 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -148.08 157.26 43.41 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.57 -35.64 80.14 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.187 0.518 . . . . 0.0 111.241 -176.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.0 p-80 -95.89 11.28 34.37 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.882 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.8 tp -114.4 111.97 22.28 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 121.663 0.744 . . . . 0.0 109.086 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -94.86 15.72 17.84 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.704 -174.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -60.79 -48.79 80.22 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.721 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.0 m -90.24 127.4 36.13 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.78 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.4 m -50.55 -42.2 55.08 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 125.832 1.653 . . . . 0.0 112.687 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.402 ' HB3' ' HD3' ' A' ' 29' ' ' PRO . 29.9 p -83.66 -23.13 31.91 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? 61.61 16.39 7.66 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.18 0.592 . . . . 0.0 110.86 -172.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 13.7 mmmm -90.74 150.71 21.51 Favored 'General case' 0 CA--C 1.48 -1.73 0 O-C-N 122.086 -0.384 . . . . 0.0 110.98 -177.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.4 m -127.09 142.57 51.49 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-N 114.556 -1.202 . . . . 0.0 112.277 -173.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.419 HD22 ' HB2' ' A' ' 25' ' ' LYS . 33.5 p30 -104.31 -177.66 3.43 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.324 174.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -62.64 -15.22 50.93 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -100.18 5.59 44.77 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 121.998 -0.439 . . . . 0.0 111.487 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 t30 71.64 17.04 5.66 Favored 'General case' 0 N--CA 1.505 2.317 0 CA-C-O 123.394 1.568 . . . . 0.0 108.9 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB2' HD22 ' A' ' 21' ' ' ASN . 68.9 mttm -94.53 158.32 15.59 Favored 'General case' 0 N--CA 1.415 -2.213 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.297 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.654 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.0 m -74.51 150.88 39.62 Favored 'General case' 0 C--N 1.281 -2.407 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.123 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.401 ' O ' ' HB2' ' A' ' 19' ' ' LYS . 3.0 m -130.57 116.96 37.26 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.348 0.594 . . . . 0.0 109.477 170.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 24.6 tp -90.29 142.68 28.61 Favored Pre-proline 0 C--N 1.289 -2.031 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 17' ' ' SER . 85.0 Cg_exo -51.77 154.61 9.3 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 123.099 2.532 . . . . 0.0 113.028 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.46 -22.93 35.0 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.4 p -77.85 87.89 4.06 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 123.95 -97.25 0.55 Allowed Glycine 0 N--CA 1.423 -2.223 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.99 -13.83 63.62 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 121.212 -0.518 . . . . 0.0 113.602 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.18 0 C-N-CA 121.37 -0.443 . . . . 0.0 112.747 -176.767 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.435 -1.222 0 CA-C-O 121.224 0.535 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -69.68 135.39 49.8 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.424 HG13 ' HG2' ' A' ' 6' ' ' GLN . 30.0 pt . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 . . . . . 0 C--O 1.238 0.479 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.424 ' HG2' HG13 ' A' ' 3' ' ' ILE . 84.3 mm-40 -83.4 152.07 25.2 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 120.647 0.261 . . . . 0.0 110.418 177.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.42 122.51 27.59 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.392 178.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 26' ' ' CYS . 25.3 p -129.15 155.75 45.0 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -122.37 -174.31 2.88 Favored 'General case' 0 C--N 1.293 -1.863 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.298 -176.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -69.41 -40.02 77.58 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -175.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -105.38 -21.55 13.21 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.302 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 mp -114.09 103.6 11.29 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.068 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.455 ' OD1' ' HA ' ' A' ' 18' ' ' ARG . 1.6 p30 -148.93 163.0 38.74 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -133.1 31.44 3.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.2 m -95.92 139.06 32.67 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.883 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 m -60.3 -37.97 82.19 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 121.549 0.69 . . . . 0.0 110.651 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -85.97 -10.32 55.33 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.72 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.455 ' HA ' ' OD1' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 62.07 17.86 9.47 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.583 1.153 . . . . 0.0 110.949 -174.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -105.18 140.94 37.58 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 121.774 0.797 . . . . 0.0 112.233 -173.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.7 m -131.2 147.87 52.64 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -84.52 -175.27 5.71 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 118.476 0.58 . . . . 0.0 110.001 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -68.63 -8.23 40.26 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -103.46 7.16 37.93 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m120 63.58 32.15 14.21 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 124.024 0.929 . . . . 0.0 112.295 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -92.33 138.48 31.48 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 174.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.473 ' HA ' ' SG ' ' A' ' 8' ' ' CYS . 42.5 t -62.76 113.98 3.35 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 124.024 0.827 . . . . 0.0 110.712 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . 0.255 24.8 m -105.24 102.69 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 CA-C-O 122.842 1.306 . . . . 0.0 112.374 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.21 155.77 91.51 Favored Pre-proline 0 C--N 1.3 -1.55 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.674 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -75.47 174.09 13.39 Favored 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 120.876 1.051 . . . . 0.0 109.938 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -29.91 69.91 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -63.72 -25.09 68.04 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.062 176.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.37 -137.21 34.96 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 128.99 -164.94 21.94 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.239 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 177.4 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.3 ttm-85 -51.6 124.65 12.71 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 119.457 1.026 . . . . 0.0 112.144 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.0 -178.79 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 . . . . . 0 N--CA 1.484 1.257 0 CA-C-O 121.271 0.558 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -69.55 153.78 42.97 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -77.92 159.31 28.95 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.476 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 18.0 p -123.26 150.98 42.82 Favored 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 112.943 -1.935 . . . . 0.0 106.009 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -126.48 174.05 8.93 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.02 -44.88 91.77 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 123.833 0.708 . . . . 0.0 111.463 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -118.43 -30.68 5.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.808 175.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.78 92.37 4.19 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.873 0.844 . . . . 0.0 111.521 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -127.42 118.2 23.62 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.082 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -123.79 12.98 9.21 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 122.861 1.315 . . . . 0.0 107.931 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m -83.86 111.1 18.91 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 m -57.38 -26.14 60.59 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 123.477 0.711 . . . . 0.0 111.786 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 p -71.45 -27.87 63.56 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.427 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 54.8 21.84 3.83 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 125.077 1.351 . . . . 0.0 113.361 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -119.88 125.22 47.97 Favored 'General case' 0 N--CA 1.415 -2.205 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.438 ' SG ' ' HA ' ' A' ' 24' ' ' ASN . 42.6 t -130.67 142.9 50.44 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.9 p30 -90.01 178.2 6.26 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 120.975 0.417 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -64.26 -18.67 64.78 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -88.62 0.97 55.84 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.675 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.438 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.9 OUTLIER 73.74 27.67 1.7 Allowed 'General case' 0 C--O 1.246 0.894 0 C-N-CA 124.15 0.98 . . . . 0.0 111.454 178.098 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -106.6 129.72 54.48 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 71.1 m -70.38 135.35 48.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.7 m -123.02 150.98 27.09 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.357 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.0 tp -90.01 141.32 27.9 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 -176.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.55 175.64 8.47 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 121.775 1.65 . . . . 0.0 112.627 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -28.93 70.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.476 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -78.28 -3.08 41.1 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.855 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.33 -145.68 29.58 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.795 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 146.55 140.26 3.43 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.538 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.437 -1.125 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -61.46 130.89 48.2 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 117.71 0.232 . . . . 0.0 110.384 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.408 ' H ' HD12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.241 0.649 0 O-C-N 124.043 0.839 . . . . 0.0 113.096 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.2 m120 . . . . . 0 CA--C 1.491 -1.289 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.3 mm-40 -99.09 175.59 5.85 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.985 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 150.17 21.81 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.281 -178.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.2 p -147.16 161.22 41.34 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.488 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.428 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 91.8 m-85 -134.06 -170.86 2.6 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -70.04 -49.4 51.66 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -103.11 -4.04 25.04 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.923 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 79.9 mt -99.92 94.03 6.08 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -95.36 80.14 3.5 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.515 -178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.57 -49.21 56.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.68 0.753 . . . . 0.0 109.171 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -80.06 141.94 35.38 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.125 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.19 -21.84 62.1 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 124.183 0.993 . . . . 0.0 110.513 -175.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.7 p -70.24 -28.08 64.97 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.308 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 57.0 26.88 12.43 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.489 1.116 . . . . 0.0 111.49 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -121.08 120.58 35.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.039 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.4 m -109.69 151.43 26.9 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.16 -178.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -103.16 -173.75 2.39 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -68.22 -11.33 59.12 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -94.06 1.67 56.15 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 68.13 22.44 8.31 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 122.403 1.097 . . . . 0.0 110.368 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -106.7 163.74 12.66 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.282 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.7 m -79.86 148.57 31.28 Favored 'General case' 0 C--N 1.284 -2.264 0 O-C-N 123.433 0.458 . . . . 0.0 110.779 -177.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.1 m -126.4 170.52 16.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.324 173.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.87 131.29 70.65 Favored Pre-proline 0 N--CA 1.434 -1.266 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.53 159.67 28.73 Favored 'Trans proline' 0 N--CA 1.444 -1.416 0 C-N-CA 122.154 1.903 . . . . 0.0 110.784 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.87 -16.98 62.15 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.738 0.78 . . . . 0.0 110.066 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.6 p -81.22 -0.32 40.07 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.81 -90.49 1.66 Allowed Glycine 0 N--CA 1.431 -1.667 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 88.73 -174.91 43.29 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.485 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.575 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.853 0.835 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.18 140.35 30.23 Favored 'General case' 0 C--N 1.264 -3.123 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.559 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 12.8 pt . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.675 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 . . . . . 0 CA--C 1.512 -0.498 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.48 141.97 51.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.75 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.505 ' N ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -67.86 145.66 54.41 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 167.661 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -115.94 145.29 43.05 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 117.443 -1.703 . . . . 0.0 113.382 -176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -137.39 133.36 34.7 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -55.26 -33.7 63.4 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -99.96 5.89 45.19 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.6 mt -91.34 139.73 30.45 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.533 -0.867 . . . . 0.0 111.444 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -82.71 -8.6 59.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.723 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -52.17 -39.44 60.06 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.329 1.052 . . . . 0.0 109.484 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 59.1 m -92.65 99.54 12.22 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.402 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.3 m -58.4 -37.4 75.24 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.49 0.662 . . . . 0.0 109.916 176.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 m -75.92 -23.72 55.49 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.8 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 53.14 23.23 2.95 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.292 1.037 . . . . 0.0 113.371 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.43 140.44 49.14 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -128.23 151.97 48.64 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.869 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -94.94 174.95 6.84 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -64.03 -12.25 36.76 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -99.86 9.95 42.14 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 122.439 -0.163 . . . . 0.0 111.288 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 t30 72.3 17.22 4.93 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 124.403 1.081 . . . . 0.0 111.269 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -93.38 146.88 23.41 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.1 t -87.97 112.52 22.66 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.3 m -102.2 162.96 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 121.392 0.615 . . . . 0.0 112.29 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.03 139.32 79.58 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.56 156.32 42.72 Favored 'Trans proline' 0 C--O 1.24 0.577 0 C-N-CA 122.304 2.003 . . . . 0.0 110.539 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.09 -20.7 62.32 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.702 0.287 . . . . 0.0 111.385 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -88.4 -9.44 52.61 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.924 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 116.61 -143.4 18.04 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.815 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.42 -148.85 19.2 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.453 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.49 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.291 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.47 ' HB2' ' HD3' ' A' ' 29' ' ' PRO . 18.3 t . . . . . 0 C--O 1.247 0.957 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -59.52 178.43 0.15 Allowed 'General case' 0 C--O 1.251 1.16 0 CA-C-O 122.312 1.053 . . . . 0.0 111.566 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.6 pt . . . . . 0 C--N 1.295 -1.764 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.086 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 . . . . . 0 N--CA 1.442 -0.859 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.42 142.18 58.51 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -93.03 124.14 36.79 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.28 151.08 52.0 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -128.75 -165.38 1.5 Allowed 'General case' 0 C--N 1.285 -2.202 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -73.74 -49.74 24.08 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.615 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -90.68 -29.91 17.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.251 0.548 . . . . 0.0 110.345 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.27 82.43 5.46 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.477 ' CG ' ' HG2' ' A' ' 18' ' ' ARG . 13.2 t70 -105.79 137.13 44.19 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.57 -178.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -128.91 -0.35 5.32 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.488 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 64.0 m -95.48 177.23 5.89 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.472 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -80.38 -33.38 37.21 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.819 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 m -134.89 24.46 3.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.607 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.477 ' HG2' ' CG ' ' A' ' 13' ' ' ASP . 58.9 mtm180 50.12 24.57 1.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 124.07 0.948 . . . . 0.0 112.808 -175.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -85.2 107.58 17.32 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.914 0.864 . . . . 0.0 111.821 -177.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 m -117.92 136.48 53.45 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.574 -1.648 . . . . 0.0 108.819 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -81.05 -177.73 6.57 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 120.757 0.313 . . . . 0.0 110.947 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -21.0 21.38 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 179.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -101.39 7.61 42.57 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.913 -0.492 . . . . 0.0 110.456 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.0 m120 66.23 25.67 10.55 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 123.943 0.897 . . . . 0.0 112.786 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -90.38 142.3 27.87 Favored 'General case' 0 N--CA 1.422 -1.828 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.556 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.4 t -67.07 125.46 26.07 Favored 'General case' 0 C--N 1.286 -2.155 0 O-C-N 124.654 1.221 . . . . 0.0 109.317 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.9 m -115.03 176.08 2.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-O 120.997 0.427 . . . . 0.0 111.008 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.61 148.7 87.95 Favored Pre-proline 0 C--N 1.303 -1.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.029 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 1' ' ' CYS . 61.0 Cg_endo -74.42 172.26 16.47 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.656 2.238 . . . . 0.0 112.241 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -103.81 -26.04 12.86 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.646 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 m -85.18 -48.21 9.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.483 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -93.74 -178.41 39.41 Favored Glycine 0 C--O 1.244 0.725 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.915 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.62 -69.59 0.98 Allowed Glycine 0 C--O 1.243 0.688 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.511 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.258 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -58.97 160.98 5.37 Favored 'General case' 0 C--O 1.249 1.028 0 C-N-CA 123.061 0.544 . . . . 0.0 111.069 175.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 pt . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.017 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 CA--C 1.502 -0.894 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -79.06 147.45 32.8 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.812 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.482 ' HE3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -88.9 149.11 23.49 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 176.617 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.3 p -145.1 141.5 28.87 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -119.46 172.05 7.91 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -54.23 -41.51 68.8 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -105.78 3.58 28.97 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.446 0.641 . . . . 0.0 110.798 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.4 mt -124.11 75.01 1.34 Allowed 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.082 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -100.24 113.84 26.83 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.008 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -113.1 -10.37 13.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.584 0.706 . . . . 0.0 110.161 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.4 m -71.9 139.46 48.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -54.18 -46.21 72.31 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.951 0.9 . . . . 0.0 111.711 -175.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t -101.33 13.69 34.3 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 51.65 30.89 7.13 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.345 1.058 . . . . 0.0 112.023 -176.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -94.01 113.71 25.75 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.5 -172.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -125.11 136.55 53.75 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -85.37 -171.75 3.78 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.989 0.423 . . . . 0.0 111.788 -178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -66.83 -10.1 44.45 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.466 0.706 . . . . 0.0 112.785 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -108.15 11.03 27.84 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.48 25.18 15.0 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.536 0.735 . . . . 0.0 111.445 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -94.71 145.69 24.68 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -71.5 135.79 47.28 Favored 'General case' 0 C--N 1.283 -2.29 0 O-C-N 124.572 1.17 . . . . 0.0 108.417 -177.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.1 m -129.72 137.06 57.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 121.385 0.612 . . . . 0.0 111.523 178.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.407 HD11 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -73.07 128.11 88.32 Favored Pre-proline 0 C--N 1.305 -1.368 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 176.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD2' HD11 ' A' ' 28' ' ' LEU . 18.8 Cg_endo -58.87 161.23 15.87 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.562 2.175 . . . . 0.0 111.823 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.42 -9.22 55.81 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.859 -175.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.3 p -69.78 -29.23 66.51 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.241 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.18 -151.69 20.86 Favored Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.544 -1.023 . . . . 0.0 110.544 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.5 30.54 Favored Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.889 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.986 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.375 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.515 ' SG ' ' HA ' ' A' ' 31' ' ' THR . 63.1 m . . . . . 0 N--CA 1.437 -1.121 0 CA-C-O 120.645 0.259 . . . . 0.0 110.77 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -64.19 152.31 41.08 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.902 0.881 . . . . 0.0 110.933 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.5 pt . . . . . 0 C--N 1.316 -0.857 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.381 175.872 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 121.028 0.442 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -72.93 158.58 35.21 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.819 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -90.0 113.95 25.71 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.93 146.74 52.06 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-O 121.673 0.749 . . . . 0.0 110.558 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.08 -173.53 2.92 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -66.51 -49.77 65.43 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.283 0.564 . . . . 0.0 110.285 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -85.36 -27.17 26.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 110.315 -178.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.2 mp -98.67 79.03 2.4 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.005 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.404 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 8.7 p-10 -93.47 126.38 38.59 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -117.77 3.27 12.28 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.403 -176.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.1 m -130.83 149.75 52.32 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 121.792 -0.567 . . . . 0.0 110.862 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -51.79 -46.49 64.21 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.145 0.978 . . . . 0.0 112.4 -178.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -84.42 -3.55 58.4 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.986 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 74.6 mtt180 51.32 29.08 4.74 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.261 1.025 . . . . 0.0 112.416 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -94.77 126.54 40.15 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-O 122.205 1.002 . . . . 0.0 110.907 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -127.96 141.79 51.43 Favored 'General case' 0 C--N 1.257 -3.433 0 CA-C-N 113.68 -1.6 . . . . 0.0 108.237 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -82.51 -176.51 6.27 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -65.95 -11.24 46.03 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.12 4.09 31.02 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 122.31 -0.244 . . . . 0.0 110.941 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m120 76.26 22.3 1.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.683 0.793 . . . . 0.0 112.495 -178.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -96.79 131.37 43.58 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.4 t -62.71 131.19 48.11 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.707 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 m -102.34 167.13 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.69 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.311 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.1 mp -58.52 114.28 8.48 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -169.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.91 162.89 38.27 Favored 'Trans proline' 0 C--O 1.243 0.77 0 C-N-CA 123.351 2.701 . . . . 0.0 112.541 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.25 -30.98 71.49 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.86 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.515 ' HA ' ' SG ' ' A' ' 1' ' ' CYS . 31.1 m 74.96 107.31 0.07 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.199 1.399 . . . . 0.0 112.599 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.12 66.06 0.42 Allowed Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.11 -69.51 3.28 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.177 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 178.623 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.441 -0.913 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.96 133.4 56.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 118.156 0.434 . . . . 0.0 109.98 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.4 pt . . . . . 0 CA--C 1.559 1.316 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -173.62 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.8 t30 . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 122.419 1.104 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -90.03 140.8 29.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -72.0 141.42 49.36 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 123.282 0.364 . . . . 0.0 111.409 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.5 p -118.92 163.87 16.29 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 50.0 m-85 -134.96 158.58 43.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.48 -26.83 68.74 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.554 0.692 . . . . 0.0 110.246 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -110.86 16.17 21.43 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.334 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 9' ' ' PHE . 37.6 tp -142.27 104.84 4.5 Favored 'General case' 0 N--CA 1.426 -1.632 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.727 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -109.07 117.26 33.72 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.625 0.726 . . . . 0.0 110.153 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -132.68 27.96 4.3 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.66 163.65 13.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.885 -1.507 . . . . 0.0 111.998 -173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.5 m -83.99 -46.26 12.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.617 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 m -96.47 -3.96 42.45 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.761 -174.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 54.87 21.34 3.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -107.2 141.77 37.96 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.067 -175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.87 152.09 28.35 Favored 'General case' 0 C--N 1.283 -2.32 0 CA-C-N 114.893 -1.049 . . . . 0.0 108.847 176.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.41 -179.63 4.98 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 174.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -67.59 -7.25 24.79 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 123.026 0.53 . . . . 0.0 112.226 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -102.71 5.17 38.81 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.18 -179.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.3 t30 70.5 20.12 6.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 123.21 1.481 . . . . 0.0 110.622 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -100.02 153.24 19.36 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.612 -1.177 . . . . 0.0 108.133 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.78 129.08 36.23 Favored 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.6 m -130.83 149.99 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.656 -177.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.5 tp -88.8 124.25 65.88 Favored Pre-proline 0 C--N 1.306 -1.307 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 172.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -74.71 -171.55 0.98 Allowed 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 122.029 1.819 . . . . 0.0 111.638 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -66.05 -23.98 66.64 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.246 0.546 . . . . 0.0 110.925 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.3 p -84.69 102.55 13.06 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 145.5 147.68 4.66 Favored Glycine 0 N--CA 1.431 -1.697 0 N-CA-C 110.214 -1.154 . . . . 0.0 110.214 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.89 -38.27 6.54 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.938 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.787 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.73 166.46 13.05 Favored 'General case' 0 C--O 1.249 1.029 0 C-N-CA 120.824 -0.351 . . . . 0.0 110.435 173.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.8 pt . . . . . 0 CA--C 1.543 0.699 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.574 -178.516 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 . . . . . 0 CA--C 1.514 -0.415 0 CA-C-O 120.768 0.318 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.436 ' HG3' ' HB3' ' A' ' 2' ' ' ARG . 16.1 mm100 -75.95 152.97 36.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.053 0.454 . . . . 0.0 110.876 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -94.92 116.81 29.18 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.7 p -118.45 160.99 20.74 Favored 'General case' 0 C--N 1.275 -2.653 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.01 -176.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -134.52 155.47 50.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -63.77 -27.7 69.37 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.396 0.617 . . . . 0.0 111.764 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -98.31 16.25 22.08 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.649 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 47.2 tp -136.45 108.25 7.07 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-O 120.917 0.389 . . . . 0.0 110.092 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -82.61 73.89 9.62 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.676 1.227 . . . . 0.0 111.512 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.51 ' O ' ' HD2' ' A' ' 2' ' ' ARG . 33.8 t70 -95.39 -29.07 14.63 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 174.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.1 m -109.92 135.47 50.73 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.9 m -50.45 -47.41 56.85 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -94.32 2.58 55.83 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.882 -173.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 55.0 30.32 13.94 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.556 0.693 . . . . 0.0 110.974 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -84.92 116.12 23.17 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.457 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.4 m -129.36 145.61 51.37 Favored 'General case' 0 C--N 1.277 -2.562 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.167 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -83.51 -174.48 5.31 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -63.01 -16.42 59.75 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -102.61 12.17 36.75 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.306 3.3 p-10 50.46 36.91 14.4 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.894 1.678 . . . . 0.0 112.066 -175.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -91.3 153.97 19.57 Favored 'General case' 0 N--CA 1.424 -1.754 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 172.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.4 t -71.86 130.97 42.34 Favored 'General case' 0 C--N 1.286 -2.175 0 O-C-N 123.855 0.722 . . . . 0.0 112.01 -172.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.4 m -124.5 113.98 38.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.812 0.815 . . . . 0.0 110.262 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.402 HD13 ' HD2' ' A' ' 29' ' ' PRO . 26.4 tp -71.26 129.88 88.53 Favored Pre-proline 0 C--N 1.31 -1.139 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.352 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD2' HD13 ' A' ' 28' ' ' LEU . 10.5 Cg_endo -53.46 110.08 0.44 Allowed 'Trans proline' 0 C--N 1.367 1.512 0 C-N-CA 123.38 2.72 . . . . 0.0 112.218 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 60.2 18.22 7.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.73 1.212 . . . . 0.0 112.289 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 m 58.37 38.39 25.81 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-O 122.124 0.964 . . . . 0.0 109.542 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -151.06 94.85 0.15 Allowed Glycine 0 N--CA 1.435 -1.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.76 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.3 154.17 19.68 Favored Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.38 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 178.405 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.85 149.2 44.9 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.426 ' C ' ' H ' ' A' ' 5' ' ' ASN . 43.4 pt . . . . . 0 C--N 1.311 -1.076 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.936 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.553 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.7 m-20 . . . . . 0 N--CA 1.472 0.639 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -81.84 150.97 27.56 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -89.96 167.51 12.74 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.588 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.9 p -154.21 147.77 25.17 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.203 -176.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -135.29 175.63 9.41 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.1 -43.11 99.39 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.3 0.571 . . . . 0.0 109.471 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.64 -1.99 58.32 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.907 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.37 104.23 7.14 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 122.232 -0.292 . . . . 0.0 111.304 -177.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -101.27 91.33 4.46 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.43 0.633 . . . . 0.0 111.212 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -97.26 -13.47 21.97 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.395 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 26.6 m -76.9 141.03 40.71 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.361 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.5 m -51.76 -46.5 64.14 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.891 1.276 . . . . 0.0 112.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 t -112.42 20.62 16.51 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 55.91 17.76 2.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.532 1.133 . . . . 0.0 113.751 -177.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -85.19 115.51 23.02 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.1 t -125.64 138.04 53.9 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -93.33 176.76 6.27 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.498 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -69.81 -2.88 13.37 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.864 0.866 . . . . 0.0 112.366 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -99.33 6.19 46.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 64.39 34.77 10.16 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.957 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.553 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -132.74 144.39 50.25 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 85.5 m -64.69 131.46 46.95 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.71 135.75 53.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 175.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.7 tp -89.99 127.04 55.25 Favored Pre-proline 0 C--N 1.294 -1.816 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.565 -172.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.28 164.06 33.55 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 121.88 1.72 . . . . 0.0 109.772 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -73.73 -18.76 60.95 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 121.359 0.599 . . . . 0.0 111.559 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -94.41 6.38 48.92 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 121.659 0.742 . . . . 0.0 109.531 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -111.89 168.67 12.82 Favored Glycine 0 CA--C 1.505 -0.586 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.646 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 C--N 1.304 -1.203 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.588 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 179.673 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 85.9 m . . . . . 0 C--O 1.244 0.793 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -66.15 168.77 7.97 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.862 173.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 pt . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.61 -177.031 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.1 m120 . . . . . 0 CA--C 1.502 -0.881 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -89.5 155.35 19.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -83.51 141.07 31.89 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.1 p -127.61 159.9 33.24 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -132.63 170.44 15.2 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.14 -38.11 72.25 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 121.029 0.443 . . . . 0.0 111.364 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -96.81 1.68 50.99 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.96 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.75 88.98 2.81 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -110.86 119.9 40.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.373 -176.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -133.49 -4.26 2.96 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.513 0.673 . . . . 0.0 111.633 170.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.5 m -79.04 145.11 34.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 174.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.82 -46.16 67.61 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.649 0.738 . . . . 0.0 111.961 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -83.84 -17.26 41.55 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.611 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.6 22.09 10.73 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.626 0.77 . . . . 0.0 110.713 -174.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.69 141.81 33.05 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 113.558 0.948 . . . . 0.0 113.558 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -130.61 138.3 50.05 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 113.068 -1.878 . . . . 0.0 109.014 -178.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.424 HD21 HG11 ' A' ' 27' ' ' VAL . 9.4 p30 -98.24 -176.0 3.28 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.281 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -56.45 -28.52 59.81 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -178.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -81.49 2.0 30.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.072 0.463 . . . . 0.0 110.995 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 69.61 16.56 8.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.986 1.314 . . . . 0.0 110.634 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -97.68 159.55 14.86 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.032 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.1 t -72.34 145.04 48.05 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 124.031 0.832 . . . . 0.0 111.154 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.424 HG11 HD21 ' A' ' 21' ' ' ASN . 11.4 m -129.29 123.77 58.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 121.507 0.67 . . . . 0.0 110.326 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.97 154.91 84.85 Favored Pre-proline 0 C--N 1.308 -1.227 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.041 -174.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -70.43 164.74 34.1 Favored 'Trans proline' 0 C--O 1.249 1.059 0 C-N-CA 122.496 2.131 . . . . 0.0 110.476 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -68.29 -35.99 78.67 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 m -72.13 -39.56 68.72 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.975 0.417 . . . . 0.0 110.163 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.81 -154.8 34.44 Favored Glycine 0 C--O 1.244 0.774 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.53 29.79 0.13 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.419 -0.896 . . . . 0.0 113.729 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.782 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.802 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.438 -1.073 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -50.43 128.66 20.4 Favored 'General case' 0 C--O 1.254 1.304 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.424 ' HA ' HD23 ' A' ' 4' ' ' HYP . 34.9 pt -65.8 115.84 4.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -164.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.424 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.464 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 4.1 p-10 -159.4 11.1 0.13 Allowed 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.923 171.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -91.24 -177.28 4.83 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.816 -1.083 . . . . 0.0 108.527 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.12 135.77 33.17 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.504 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 25.2 p -116.07 138.07 51.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.804 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -131.67 169.27 16.4 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -56.23 -47.02 79.31 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.448 0.468 . . . . 0.0 112.08 -177.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -102.41 12.02 37.15 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.091 0.472 . . . . 0.0 110.626 -173.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.26 99.86 9.23 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.59 101.89 11.01 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-O 121.347 0.594 . . . . 0.0 110.146 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.14 -52.8 1.04 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.462 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.402 ' O ' ' HD2' ' A' ' 18' ' ' ARG . 47.0 m -70.16 115.95 9.95 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -177.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 73.4 m -59.36 -28.47 66.89 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -177.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.4 t -72.6 -35.98 68.0 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.248 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' A' ' 15' ' ' CYS . 6.8 mpt_? 59.84 18.32 7.29 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.853 0.861 . . . . 0.0 111.086 -172.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -88.34 112.75 23.22 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.3 m -114.18 151.8 32.16 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 120.849 0.356 . . . . 0.0 111.054 -177.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 p30 -108.9 -176.56 3.07 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.18 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -60.37 -12.06 8.3 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 125.678 1.591 . . . . 0.0 114.119 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -104.17 7.07 36.09 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.3 m120 64.99 26.66 12.71 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.455 1.102 . . . . 0.0 110.269 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -103.83 153.43 20.75 Favored 'General case' 0 N--CA 1.42 -1.953 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.15 176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.5 m -79.93 145.01 32.86 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.19 164.99 23.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.5 175.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.59 131.15 84.75 Favored Pre-proline 0 C--N 1.309 -1.178 0 O-C-N 123.752 0.657 . . . . 0.0 110.597 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.88 178.68 7.12 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.489 2.126 . . . . 0.0 110.26 176.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.91 -23.38 41.85 Favored 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.5 m -64.45 -34.69 78.78 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.592 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.53 -148.61 18.71 Favored Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.601 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.2 60.82 0.6 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.001 0 C-N-CA 121.274 -0.489 . . . . 0.0 112.443 -178.655 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.6 t . . . . . 0 C--O 1.244 0.77 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.8 ttp180 -66.33 149.16 50.79 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.453 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.438 ' HA ' HD23 ' A' ' 4' ' ' HYP . 27.5 pt -39.24 124.95 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.59 0 C-N-CA 124.607 1.163 . . . . 0.0 113.9 -175.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.438 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -132.21 11.55 4.59 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 123.454 0.702 . . . . 0.0 109.293 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.669 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 15.5 mm100 -89.28 167.95 12.65 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.801 -178.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.517 ' O ' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.51 148.18 22.9 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.638 174.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.4 p -137.83 133.52 34.05 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.245 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -137.32 177.16 8.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -71.58 -49.68 38.22 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.984 0.421 . . . . 0.0 110.493 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -88.04 -24.12 23.57 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.428 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.9 86.71 2.64 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -91.06 110.64 21.91 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.677 -176.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -112.72 -52.46 2.78 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' HB2' ' A' ' 6' ' ' GLN . 69.4 m -86.96 133.63 33.57 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.926 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -25.78 67.8 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.039 0.935 . . . . 0.0 112.138 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 p -78.16 -35.88 48.31 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.046 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 62.03 18.78 10.24 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.19 0.996 . . . . 0.0 110.814 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -86.33 101.39 13.05 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.6 m -108.53 145.65 34.45 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.945 -173.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 p30 -93.0 -178.07 4.69 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.562 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -67.71 -2.65 7.33 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.502 0.721 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -106.34 5.04 29.25 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 120.774 0.321 . . . . 0.0 110.222 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 65.88 24.15 11.29 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.873 0.869 . . . . 0.0 111.156 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -107.2 154.4 21.28 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.3 m -73.89 149.32 41.56 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.8 m -123.05 175.92 5.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.091 174.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.429 HD11 ' HD2' ' A' ' 29' ' ' PRO . 48.0 tp -57.71 119.87 36.89 Favored Pre-proline 0 C--N 1.323 -0.563 0 O-C-N 124.175 0.922 . . . . 0.0 111.391 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.429 ' HD2' HD11 ' A' ' 28' ' ' LEU . 63.2 Cg_endo -74.26 171.27 18.37 Favored 'Trans proline' 0 C--O 1.251 1.153 0 C-N-CA 122.721 2.281 . . . . 0.0 110.691 177.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -69.02 -15.95 63.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.078 0.466 . . . . 0.0 110.178 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.7 m 81.46 112.11 0.06 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.369 1.467 . . . . 0.0 111.941 176.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.27 67.49 0.43 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.47 -65.32 0.89 Allowed Glycine 0 C--N 1.308 -1.021 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.437 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.244 0.807 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -42.91 122.98 2.58 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 124.635 1.174 . . . . 0.0 111.943 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.5 pt -65.56 158.11 4.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.942 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.4 t30 77.4 -2.07 2.64 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.404 1.482 . . . . 0.0 111.192 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -78.91 136.15 37.19 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 172.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -82.55 141.52 32.55 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.554 -1.258 . . . . 0.0 111.032 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.0 p -125.31 149.46 48.06 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -125.97 177.07 6.55 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -58.16 -41.62 84.2 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -174.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -110.0 13.12 23.47 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.223 0.535 . . . . 0.0 110.634 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.7 mp -120.33 102.49 8.51 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.842 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -125.98 117.61 23.64 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.697 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -132.46 22.6 4.36 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 106.457 -1.682 . . . . 0.0 106.457 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.4 m -100.45 147.16 26.17 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.482 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.5 m -81.46 -37.89 27.26 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -80.64 -24.89 38.69 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.296 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.4 mtm-85 56.04 28.29 12.6 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.07 0.948 . . . . 0.0 110.943 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -109.66 125.35 52.51 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.515 -176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.1 m -117.88 139.19 51.47 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 p30 -89.43 -174.83 4.51 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 120.834 0.349 . . . . 0.0 110.907 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.4 ptt180 -62.86 -4.87 2.37 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.363 1.465 . . . . 0.0 114.033 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.96 16.3 15.12 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.157 -0.34 . . . . 0.0 110.552 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.8 19.14 11.31 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.204 0.526 . . . . 0.0 111.007 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -92.07 135.31 34.07 Favored 'General case' 0 N--CA 1.428 -1.567 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.0 t -70.93 134.16 47.0 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.8 m -119.65 150.28 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.33 143.45 69.03 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.224 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -56.36 110.33 0.56 Allowed 'Trans proline' 0 C--O 1.243 0.728 0 C-N-CA 122.33 2.02 . . . . 0.0 110.397 174.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.54 -26.47 30.09 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 -175.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.3 m -81.48 -21.27 38.83 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 121.455 0.645 . . . . 0.0 109.678 -177.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.63 135.21 1.87 Allowed Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.704 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 122.96 2.29 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 119.937 -1.125 . . . . 0.0 112.775 177.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.388 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 177.816 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.915 0 CA-C-O 122.54 1.162 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -103.04 123.35 46.47 Favored 'General case' 0 C--N 1.275 -2.654 0 CA-C-N 112.709 -2.042 . . . . 0.0 105.558 177.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -56.0 119.77 2.39 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 O-C-N 123.648 0.592 . . . . 0.0 111.112 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.463 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -138.6 10.37 2.69 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -97.59 162.34 13.34 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.504 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -84.38 132.68 34.56 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.684 0.615 . . . . 0.0 110.488 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -138.29 145.0 40.71 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-O 121.755 0.788 . . . . 0.0 110.661 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.67 -164.96 1.28 Allowed 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -72.33 -46.41 55.72 Favored 'General case' 0 N--CA 1.42 -1.931 0 CA-C-O 120.754 0.311 . . . . 0.0 111.157 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -105.28 -7.22 19.06 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 120.976 0.417 . . . . 0.0 112.098 -176.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mp -114.89 93.81 4.48 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -153.89 138.3 16.73 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -133.76 -0.15 3.18 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.812 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -70.11 131.59 44.52 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.219 -0.301 . . . . 0.0 110.533 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.8 m -58.63 -32.2 68.82 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.462 0.649 . . . . 0.0 110.032 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.25 -36.21 79.38 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.76 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.17 26.51 10.37 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.598 1.159 . . . . 0.0 111.745 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.415 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 59.1 tttp -126.34 132.19 51.64 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.1 m -119.96 142.8 48.43 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.203 0.314 . . . . 0.0 110.545 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -90.38 -179.19 5.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -58.47 -29.33 66.12 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -88.53 13.59 11.7 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.706 0.288 . . . . 0.0 111.292 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 m120 64.86 29.81 12.37 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -109.43 147.94 31.99 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.652 -0.819 . . . . 0.0 109.112 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 4' ' ' HYP . 59.7 m -62.7 142.59 58.05 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 124.07 0.856 . . . . 0.0 110.848 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.9 168.78 21.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -88.77 122.93 68.8 Favored Pre-proline 0 C--N 1.312 -1.037 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -81.65 -166.64 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.52 2.814 . . . . 0.0 110.236 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 mp0 -76.31 -33.19 59.04 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.9 p -77.75 -16.76 58.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.273 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.11 -147.16 23.4 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.335 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 115.89 54.1 0.36 Allowed Glycine 0 C--N 1.301 -1.389 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 C-N-CA 121.578 -0.344 . . . . 0.0 113.566 -176.391 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -57.79 141.34 49.21 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pp -82.22 152.65 4.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.879 -176.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.568 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 t30 82.87 -24.68 0.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.616 1.566 . . . . 0.0 112.372 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.96 145.02 52.03 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -77.45 139.46 39.66 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 p -119.95 133.81 55.44 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -125.33 143.03 51.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 121.254 0.549 . . . . 0.0 111.869 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.419 ' HG3' ' ND1' ' A' ' 11' ' ' HIS . 11.8 pt20 -61.85 -16.18 48.12 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.317 1.047 . . . . 0.0 113.797 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.419 ' ND1' ' HG3' ' A' ' 10' ' ' GLN . 76.1 m80 -112.5 13.72 20.16 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.023 -0.423 . . . . 0.0 111.938 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -121.82 165.19 16.25 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -115.0 30.66 7.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.649 0.738 . . . . 0.0 109.194 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -48.44 -52.53 21.69 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.019 1.328 . . . . 0.0 112.858 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.415 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 74.7 m -108.63 152.36 24.9 Favored 'General case' 0 C--N 1.278 -2.514 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.146 176.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -59.55 -45.63 91.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 t -108.37 -15.72 14.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.831 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.415 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 82.8 mtm180 49.35 51.01 17.13 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.505 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.45 100.82 4.61 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.7 m -96.55 130.43 43.73 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.02 -173.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.412 HD22 ' HB2' ' A' ' 25' ' ' LYS . 34.8 p30 -80.27 -175.87 5.32 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.465 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -67.51 -2.95 7.32 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -115.52 12.65 16.23 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.3 m120 63.66 23.57 13.58 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.944 0.878 . . . . 0.0 110.93 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HB2' HD22 ' A' ' 21' ' ' ASN . 98.4 mttt -96.91 146.12 25.25 Favored 'General case' 0 N--CA 1.411 -2.375 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.129 174.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.568 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 27.3 t -84.71 143.52 29.13 Favored 'General case' 0 C--N 1.256 -3.488 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.448 -174.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 m -125.25 136.48 60.71 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.075 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -55.9 147.33 43.83 Favored Pre-proline 0 C--O 1.244 0.777 0 O-C-N 123.656 0.598 . . . . 0.0 112.169 -174.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.87 136.63 43.54 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.257 2.638 . . . . 0.0 111.349 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -70.25 -9.89 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 p -77.47 -30.3 53.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 121.326 0.584 . . . . 0.0 110.017 172.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.67 168.15 31.04 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.575 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.57 173.86 13.18 Favored Glycine 0 N--CA 1.427 -1.915 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.147 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.108 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 178.401 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.484 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 tpp180 -67.03 127.93 34.45 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 173.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 pt -59.35 149.22 6.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 O-C-N 123.951 0.782 . . . . 0.0 111.659 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.561 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 80.01 -9.28 1.43 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.813 1.245 . . . . 0.0 112.552 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -79.63 151.88 30.32 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.496 ' HZ2' ' HB3' ' A' ' 7' ' ' LYS . 5.1 mmmp? -74.46 130.55 39.83 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.069 0.461 . . . . 0.0 112.098 177.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 p -114.54 159.04 20.85 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 175.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -146.0 163.48 35.06 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 -177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -75.44 -15.74 60.4 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.162 0.506 . . . . 0.0 112.216 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -101.56 12.13 37.78 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.691 0.757 . . . . 0.0 110.091 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.9 tp -120.03 149.61 41.88 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.23 19.44 2.77 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.509 -1.276 . . . . 0.0 112.369 -174.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 2' ' ' ARG . 7.9 m-20 -67.71 -17.07 64.44 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.0 m -85.76 110.36 19.29 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.5 m -53.33 -44.78 68.73 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.6 t -102.56 9.88 39.16 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.475 0.655 . . . . 0.0 110.139 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.496 ' HD2' ' N ' ' A' ' 18' ' ' ARG . 4.5 mpt_? 59.08 31.25 21.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.104 0.962 . . . . 0.0 111.63 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.45 120.14 25.09 Favored 'General case' 0 CA--C 1.501 -0.927 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.254 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.5 m -131.02 148.93 52.81 Favored 'General case' 0 C--N 1.275 -2.67 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.594 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -88.41 176.92 6.98 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -66.39 -15.14 63.07 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -95.89 6.19 49.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 120.734 0.302 . . . . 0.0 111.122 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 71.69 32.66 1.93 Allowed 'General case' 0 C--O 1.26 1.619 0 C-N-CA 123.877 0.871 . . . . 0.0 112.185 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.82 149.25 25.22 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 172.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.561 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 21.2 t -78.93 135.15 36.88 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -176.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 m -118.21 145.28 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 CA-C-O 120.958 0.408 . . . . 0.0 110.436 177.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.404 HD11 ' HD2' ' A' ' 29' ' ' PRO . 29.2 tp -67.82 127.28 93.35 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.921 -171.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.404 ' HD2' HD11 ' A' ' 28' ' ' LEU . 78.3 Cg_endo -82.83 175.87 8.24 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.773 2.315 . . . . 0.0 111.42 175.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -92.12 -48.26 6.81 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.154 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.7 m -59.94 -48.32 82.17 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -115.52 149.59 18.82 Favored Glycine 0 N--CA 1.434 -1.44 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.549 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.24 -27.78 5.18 Favored Glycine 0 C--N 1.306 -1.092 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.774 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 CA-C-O 121.505 0.503 . . . . 0.0 111.986 -178.018 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 122.309 1.052 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.485 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 17.6 tpp180 -100.01 139.19 36.04 Favored 'General case' 0 C--N 1.273 -2.755 0 CA-C-N 113.823 -1.535 . . . . 0.0 106.914 168.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.8 pt -63.29 147.88 11.77 Favored 'Isoleucine or valine' 0 C--O 1.246 0.909 0 O-C-N 123.267 0.354 . . . . 0.0 110.701 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 76.27 -5.32 2.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.004 1.322 . . . . 0.0 112.527 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -84.06 158.38 21.46 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -80.74 126.08 30.86 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 120.736 0.303 . . . . 0.0 110.46 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 p -131.12 138.59 49.58 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -129.95 175.77 8.6 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -64.16 -19.93 65.65 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -118.22 13.47 13.74 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.399 0.619 . . . . 0.0 110.045 175.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -135.21 35.07 3.03 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.473 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 11.1 m-20 -79.44 87.59 5.06 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.802 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -87.78 -12.71 44.29 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.797 0.808 . . . . 0.0 109.814 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.485 ' SG ' ' HB3' ' A' ' 2' ' ' ARG . 29.7 m -81.16 118.22 22.37 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 173.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.6 m -63.86 -32.84 74.49 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -169.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -81.86 -7.94 59.64 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.592 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.473 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 77.6 mtp180 57.52 28.54 15.7 Favored 'General case' 0 C--N 1.358 0.936 0 C-N-CA 124.877 1.271 . . . . 0.0 111.413 -176.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.6 tttm -83.16 100.53 10.61 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -128.1 144.79 51.13 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.651 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -89.39 -179.1 5.76 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 120.964 0.412 . . . . 0.0 111.301 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -63.47 -18.07 63.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -93.58 5.24 52.27 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.134 0.492 . . . . 0.0 109.717 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 68.52 24.39 7.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.306 1.043 . . . . 0.0 110.882 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -97.11 135.83 38.52 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.3 t -68.05 135.98 53.1 Favored 'General case' 0 C--N 1.287 -2.145 0 O-C-N 123.559 0.537 . . . . 0.0 109.653 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.2 m -117.62 143.03 29.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 CA-C-O 120.601 0.239 . . . . 0.0 110.544 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.4 tp -67.48 125.51 91.27 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.845 -172.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -69.11 107.87 1.83 Allowed 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.672 2.248 . . . . 0.0 108.72 170.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -15.62 62.2 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.252 0.549 . . . . 0.0 112.056 -174.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -112.51 9.52 19.56 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.037 0.922 . . . . 0.0 108.936 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -145.23 -133.54 2.61 Favored Glycine 0 N--CA 1.435 -1.37 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -157.89 152.14 23.34 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.489 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.034 -178.132 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.417 ' HB2' ' HG ' ' A' ' 28' ' ' LEU . 33.6 m . . . . . 0 N--CA 1.443 -0.812 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -62.11 136.28 57.88 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 pt -49.59 135.37 7.65 Favored 'Isoleucine or valine' 0 C--O 1.254 1.342 0 O-C-N 123.753 0.658 . . . . 0.0 111.941 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.595 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -136.8 -22.97 1.21 Allowed 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.979 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -76.09 164.65 25.91 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 27.6 mtpp -78.38 171.23 15.39 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.137 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -117.83 133.46 55.91 Favored 'General case' 0 C--N 1.285 -2.225 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -125.53 160.55 29.26 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -62.14 -25.57 67.82 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 123.489 0.716 . . . . 0.0 112.462 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -101.92 6.23 41.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.702 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.7 tp -97.65 95.16 7.4 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.236 0.541 . . . . 0.0 110.175 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -97.02 10.89 37.98 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.539 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -78.41 -23.79 46.55 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.448 1.118 . . . . 0.0 108.443 178.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.1 m -79.88 107.49 12.7 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 170.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.3 m -52.31 -47.09 66.14 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.716 0.635 . . . . 0.0 112.665 -169.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.7 m -98.85 4.83 47.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.771 -177.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 53.37 30.78 10.82 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.449 0.7 . . . . 0.0 110.358 -175.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -83.26 130.72 35.09 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.112 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 63.7 m -120.17 151.68 38.76 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.217 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.5 p30 -99.89 -176.16 3.17 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -62.61 -11.92 19.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.9 12.03 29.29 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 121.888 -0.507 . . . . 0.0 110.745 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 66.28 25.13 10.56 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 122.136 0.969 . . . . 0.0 108.95 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 68.3 mttm -93.81 160.4 14.76 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.572 176.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 52.2 t -84.67 143.93 28.9 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.0 m -140.22 154.2 22.77 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 CA-C-O 120.97 0.414 . . . . 0.0 110.036 175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 1' ' ' CYS . 7.8 mp -90.29 154.73 46.85 Favored Pre-proline 0 C--N 1.305 -1.365 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.06 179.95 5.26 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 122.291 1.994 . . . . 0.0 111.01 174.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.56 -32.16 73.08 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 122.79 0.436 . . . . 0.0 111.412 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.9 p -83.58 2.73 35.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.59 -113.29 4.17 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.366 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.14 170.9 29.69 Favored Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.304 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 179.335 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.955 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -46.87 123.59 5.34 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.552 1.141 . . . . 0.0 110.612 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.405 ' HA ' HD23 ' A' ' 4' ' ' HYP . 33.6 pt -58.25 151.43 4.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -174.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.405 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -108.55 1.65 21.59 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.238 1.018 . . . . 0.0 109.397 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -83.83 168.34 16.22 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.309 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -86.83 132.37 33.85 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.654 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 27.7 p -115.0 141.55 47.84 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -148.08 157.26 43.41 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.57 -35.64 80.14 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.187 0.518 . . . . 0.0 111.241 -176.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.0 p-80 -95.89 11.28 34.37 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.882 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.8 tp -114.4 111.97 22.28 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 121.663 0.744 . . . . 0.0 109.086 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -94.86 15.72 17.84 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.704 -174.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -60.79 -48.79 80.22 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.721 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.0 m -90.24 127.4 36.13 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.78 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.4 m -50.55 -42.2 55.08 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 125.832 1.653 . . . . 0.0 112.687 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.402 ' HB3' ' HD3' ' A' ' 29' ' ' PRO . 29.9 p -83.66 -23.13 31.91 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? 61.61 16.39 7.66 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.18 0.592 . . . . 0.0 110.86 -172.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 13.7 mmmm -90.74 150.71 21.51 Favored 'General case' 0 CA--C 1.48 -1.73 0 O-C-N 122.086 -0.384 . . . . 0.0 110.98 -177.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.4 m -127.09 142.57 51.49 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-N 114.556 -1.202 . . . . 0.0 112.277 -173.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.419 HD22 ' HB2' ' A' ' 25' ' ' LYS . 33.5 p30 -104.31 -177.66 3.43 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.324 174.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -62.64 -15.22 50.93 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -100.18 5.59 44.77 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 121.998 -0.439 . . . . 0.0 111.487 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 t30 71.64 17.04 5.66 Favored 'General case' 0 N--CA 1.505 2.317 0 CA-C-O 123.394 1.568 . . . . 0.0 108.9 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB2' HD22 ' A' ' 21' ' ' ASN . 68.9 mttm -94.53 158.32 15.59 Favored 'General case' 0 N--CA 1.415 -2.213 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.297 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.654 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.0 m -74.51 150.88 39.62 Favored 'General case' 0 C--N 1.281 -2.407 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.123 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.401 ' O ' ' HB2' ' A' ' 19' ' ' LYS . 3.0 m -130.57 116.96 37.26 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.348 0.594 . . . . 0.0 109.477 170.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 24.6 tp -90.29 142.68 28.61 Favored Pre-proline 0 C--N 1.289 -2.031 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 17' ' ' SER . 85.0 Cg_exo -51.77 154.61 9.3 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 123.099 2.532 . . . . 0.0 113.028 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.46 -22.93 35.0 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.4 p -77.85 87.89 4.06 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 123.95 -97.25 0.55 Allowed Glycine 0 N--CA 1.423 -2.223 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.99 -13.83 63.62 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 121.212 -0.518 . . . . 0.0 113.602 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.18 0 C-N-CA 121.37 -0.443 . . . . 0.0 112.747 -176.767 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.435 -1.222 0 CA-C-O 121.224 0.535 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -69.68 135.39 49.8 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.424 HG13 ' HG2' ' A' ' 6' ' ' GLN . 30.0 pt -53.89 138.18 13.8 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -176.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.413 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -87.88 7.88 28.69 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -175.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.424 ' HG2' HG13 ' A' ' 3' ' ' ILE . 84.3 mm-40 -83.4 152.07 25.2 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 120.647 0.261 . . . . 0.0 110.418 177.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.42 122.51 27.59 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.392 178.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 26' ' ' CYS . 25.3 p -129.15 155.75 45.0 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -122.37 -174.31 2.88 Favored 'General case' 0 C--N 1.293 -1.863 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.298 -176.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -69.41 -40.02 77.58 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -175.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -105.38 -21.55 13.21 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.302 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 mp -114.09 103.6 11.29 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.068 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.455 ' OD1' ' HA ' ' A' ' 18' ' ' ARG . 1.6 p30 -148.93 163.0 38.74 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -133.1 31.44 3.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.2 m -95.92 139.06 32.67 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.883 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 m -60.3 -37.97 82.19 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 121.549 0.69 . . . . 0.0 110.651 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -85.97 -10.32 55.33 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.72 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.455 ' HA ' ' OD1' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 62.07 17.86 9.47 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.583 1.153 . . . . 0.0 110.949 -174.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -105.18 140.94 37.58 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 121.774 0.797 . . . . 0.0 112.233 -173.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.7 m -131.2 147.87 52.64 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -84.52 -175.27 5.71 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 118.476 0.58 . . . . 0.0 110.001 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -68.63 -8.23 40.26 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -103.46 7.16 37.93 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m120 63.58 32.15 14.21 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 124.024 0.929 . . . . 0.0 112.295 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -92.33 138.48 31.48 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 174.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.473 ' HA ' ' SG ' ' A' ' 8' ' ' CYS . 42.5 t -62.76 113.98 3.35 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 124.024 0.827 . . . . 0.0 110.712 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . 0.255 24.8 m -105.24 102.69 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 CA-C-O 122.842 1.306 . . . . 0.0 112.374 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.21 155.77 91.51 Favored Pre-proline 0 C--N 1.3 -1.55 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.674 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -75.47 174.09 13.39 Favored 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 120.876 1.051 . . . . 0.0 109.938 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -29.91 69.91 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -63.72 -25.09 68.04 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.062 176.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.37 -137.21 34.96 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 128.99 -164.94 21.94 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.239 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 177.4 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.3 ttm-85 -51.6 124.65 12.71 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 119.457 1.026 . . . . 0.0 112.144 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt -65.33 155.52 6.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.0 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 83.65 -15.18 0.64 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 126.483 1.913 . . . . 0.0 111.737 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -69.55 153.78 42.97 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -77.92 159.31 28.95 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 18.0 p -123.26 150.98 42.82 Favored 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 112.943 -1.935 . . . . 0.0 106.009 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -126.48 174.05 8.93 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.02 -44.88 91.77 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 123.833 0.708 . . . . 0.0 111.463 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -118.43 -30.68 5.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.808 175.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.78 92.37 4.19 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.873 0.844 . . . . 0.0 111.521 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -127.42 118.2 23.62 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.082 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -123.79 12.98 9.21 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 122.861 1.315 . . . . 0.0 107.931 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m -83.86 111.1 18.91 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 m -57.38 -26.14 60.59 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 123.477 0.711 . . . . 0.0 111.786 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 p -71.45 -27.87 63.56 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.427 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 54.8 21.84 3.83 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 125.077 1.351 . . . . 0.0 113.361 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -119.88 125.22 47.97 Favored 'General case' 0 N--CA 1.415 -2.205 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.438 ' SG ' ' HA ' ' A' ' 24' ' ' ASN . 42.6 t -130.67 142.9 50.44 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.9 p30 -90.01 178.2 6.26 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 120.975 0.417 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -64.26 -18.67 64.78 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -88.62 0.97 55.84 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.675 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.438 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.9 OUTLIER 73.74 27.67 1.7 Allowed 'General case' 0 C--O 1.246 0.894 0 C-N-CA 124.15 0.98 . . . . 0.0 111.454 178.098 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -106.6 129.72 54.48 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 71.1 m -70.38 135.35 48.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.7 m -123.02 150.98 27.09 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.357 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.0 tp -90.01 141.32 27.9 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 -176.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.55 175.64 8.47 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 121.775 1.65 . . . . 0.0 112.627 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -28.93 70.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.476 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -78.28 -3.08 41.1 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.855 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.33 -145.68 29.58 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.795 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 146.55 140.26 3.43 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.538 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.437 -1.125 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -61.46 130.89 48.2 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 117.71 0.232 . . . . 0.0 110.384 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.408 ' H ' HD12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -53.8 140.67 10.04 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 O-C-N 124.043 0.839 . . . . 0.0 113.096 -178.35 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -127.05 9.45 6.82 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.3 mm-40 -99.09 175.59 5.85 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.985 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 150.17 21.81 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.281 -178.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.2 p -147.16 161.22 41.34 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.488 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.428 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 91.8 m-85 -134.06 -170.86 2.6 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -70.04 -49.4 51.66 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -103.11 -4.04 25.04 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.923 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 79.9 mt -99.92 94.03 6.08 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -95.36 80.14 3.5 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.515 -178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.57 -49.21 56.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.68 0.753 . . . . 0.0 109.171 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -80.06 141.94 35.38 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.125 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.19 -21.84 62.1 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 124.183 0.993 . . . . 0.0 110.513 -175.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.7 p -70.24 -28.08 64.97 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.308 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 57.0 26.88 12.43 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.489 1.116 . . . . 0.0 111.49 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -121.08 120.58 35.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.039 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.4 m -109.69 151.43 26.9 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.16 -178.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -103.16 -173.75 2.39 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -68.22 -11.33 59.12 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -94.06 1.67 56.15 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 68.13 22.44 8.31 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 122.403 1.097 . . . . 0.0 110.368 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -106.7 163.74 12.66 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.282 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.7 m -79.86 148.57 31.28 Favored 'General case' 0 C--N 1.284 -2.264 0 O-C-N 123.433 0.458 . . . . 0.0 110.779 -177.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.1 m -126.4 170.52 16.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.324 173.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.87 131.29 70.65 Favored Pre-proline 0 N--CA 1.434 -1.266 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.53 159.67 28.73 Favored 'Trans proline' 0 N--CA 1.444 -1.416 0 C-N-CA 122.154 1.903 . . . . 0.0 110.784 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.87 -16.98 62.15 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.738 0.78 . . . . 0.0 110.066 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.6 p -81.22 -0.32 40.07 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.81 -90.49 1.66 Allowed Glycine 0 N--CA 1.431 -1.667 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 88.73 -174.91 43.29 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.485 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.575 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.853 0.835 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.18 140.35 30.23 Favored 'General case' 0 C--N 1.264 -3.123 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.559 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.424 ' HA ' HD23 ' A' ' 4' ' ' HYP . 12.8 pt -72.53 133.07 32.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.424 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.96 0.19 10.74 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.48 141.97 51.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.75 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.505 ' N ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -67.86 145.66 54.41 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 167.661 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -115.94 145.29 43.05 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 117.443 -1.703 . . . . 0.0 113.382 -176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -137.39 133.36 34.7 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -55.26 -33.7 63.4 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -99.96 5.89 45.19 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.6 mt -91.34 139.73 30.45 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.533 -0.867 . . . . 0.0 111.444 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -82.71 -8.6 59.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.723 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -52.17 -39.44 60.06 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.329 1.052 . . . . 0.0 109.484 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 59.1 m -92.65 99.54 12.22 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.402 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.3 m -58.4 -37.4 75.24 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.49 0.662 . . . . 0.0 109.916 176.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 m -75.92 -23.72 55.49 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.8 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 53.14 23.23 2.95 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.292 1.037 . . . . 0.0 113.371 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.43 140.44 49.14 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -128.23 151.97 48.64 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.869 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -94.94 174.95 6.84 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -64.03 -12.25 36.76 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -99.86 9.95 42.14 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 122.439 -0.163 . . . . 0.0 111.288 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 t30 72.3 17.22 4.93 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 124.403 1.081 . . . . 0.0 111.269 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -93.38 146.88 23.41 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.1 t -87.97 112.52 22.66 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.3 m -102.2 162.96 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 121.392 0.615 . . . . 0.0 112.29 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.03 139.32 79.58 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.56 156.32 42.72 Favored 'Trans proline' 0 C--O 1.24 0.577 0 C-N-CA 122.304 2.003 . . . . 0.0 110.539 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.09 -20.7 62.32 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.702 0.287 . . . . 0.0 111.385 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -88.4 -9.44 52.61 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.924 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 116.61 -143.4 18.04 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.815 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.42 -148.85 19.2 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.453 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.49 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.291 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.47 ' HB2' ' HD3' ' A' ' 29' ' ' PRO . 18.3 t . . . . . 0 C--O 1.247 0.957 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -59.52 178.43 0.15 Allowed 'General case' 0 C--O 1.251 1.16 0 CA-C-O 122.312 1.053 . . . . 0.0 111.566 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.6 pt -76.2 133.02 31.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.448 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -125.86 3.9 7.36 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 174.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.42 142.18 58.51 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -93.03 124.14 36.79 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.28 151.08 52.0 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -128.75 -165.38 1.5 Allowed 'General case' 0 C--N 1.285 -2.202 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -73.74 -49.74 24.08 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.615 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -90.68 -29.91 17.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.251 0.548 . . . . 0.0 110.345 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.27 82.43 5.46 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.477 ' CG ' ' HG2' ' A' ' 18' ' ' ARG . 13.2 t70 -105.79 137.13 44.19 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.57 -178.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -128.91 -0.35 5.32 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.488 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 64.0 m -95.48 177.23 5.89 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.472 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -80.38 -33.38 37.21 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.819 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 m -134.89 24.46 3.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.607 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.477 ' HG2' ' CG ' ' A' ' 13' ' ' ASP . 58.9 mtm180 50.12 24.57 1.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 124.07 0.948 . . . . 0.0 112.808 -175.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -85.2 107.58 17.32 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.914 0.864 . . . . 0.0 111.821 -177.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 m -117.92 136.48 53.45 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.574 -1.648 . . . . 0.0 108.819 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -81.05 -177.73 6.57 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 120.757 0.313 . . . . 0.0 110.947 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -21.0 21.38 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 179.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -101.39 7.61 42.57 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.913 -0.492 . . . . 0.0 110.456 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.0 m120 66.23 25.67 10.55 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 123.943 0.897 . . . . 0.0 112.786 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -90.38 142.3 27.87 Favored 'General case' 0 N--CA 1.422 -1.828 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.556 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 18.4 t -67.07 125.46 26.07 Favored 'General case' 0 C--N 1.286 -2.155 0 O-C-N 124.654 1.221 . . . . 0.0 109.317 178.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.9 m -115.03 176.08 2.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-O 120.997 0.427 . . . . 0.0 111.008 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.61 148.7 87.95 Favored Pre-proline 0 C--N 1.303 -1.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.029 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 1' ' ' CYS . 61.0 Cg_endo -74.42 172.26 16.47 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.656 2.238 . . . . 0.0 112.241 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -103.81 -26.04 12.86 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.646 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 m -85.18 -48.21 9.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.483 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -93.74 -178.41 39.41 Favored Glycine 0 C--O 1.244 0.725 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.915 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.62 -69.59 0.98 Allowed Glycine 0 C--O 1.243 0.688 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.511 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.258 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -58.97 160.98 5.37 Favored 'General case' 0 C--O 1.249 1.028 0 C-N-CA 123.061 0.544 . . . . 0.0 111.069 175.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 pt -77.45 149.43 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.64 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -116.37 -0.86 12.43 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.738 -0.601 . . . . 0.0 111.995 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -79.06 147.45 32.8 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.812 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.482 ' HE3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -88.9 149.11 23.49 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 176.617 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.3 p -145.1 141.5 28.87 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -119.46 172.05 7.91 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -54.23 -41.51 68.8 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -105.78 3.58 28.97 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.446 0.641 . . . . 0.0 110.798 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.4 mt -124.11 75.01 1.34 Allowed 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.082 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -100.24 113.84 26.83 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.008 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -113.1 -10.37 13.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.584 0.706 . . . . 0.0 110.161 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.4 m -71.9 139.46 48.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -54.18 -46.21 72.31 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.951 0.9 . . . . 0.0 111.711 -175.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t -101.33 13.69 34.3 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 51.65 30.89 7.13 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.345 1.058 . . . . 0.0 112.023 -176.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -94.01 113.71 25.75 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.5 -172.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -125.11 136.55 53.75 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -85.37 -171.75 3.78 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.989 0.423 . . . . 0.0 111.788 -178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -66.83 -10.1 44.45 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.466 0.706 . . . . 0.0 112.785 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -108.15 11.03 27.84 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.48 25.18 15.0 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.536 0.735 . . . . 0.0 111.445 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -94.71 145.69 24.68 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.64 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 12.2 t -71.5 135.79 47.28 Favored 'General case' 0 C--N 1.283 -2.29 0 O-C-N 124.572 1.17 . . . . 0.0 108.417 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.1 m -129.72 137.06 57.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 121.385 0.612 . . . . 0.0 111.523 178.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.407 HD11 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -73.07 128.11 88.32 Favored Pre-proline 0 C--N 1.305 -1.368 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 176.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD2' HD11 ' A' ' 28' ' ' LEU . 18.8 Cg_endo -58.87 161.23 15.87 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.562 2.175 . . . . 0.0 111.823 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.42 -9.22 55.81 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.859 -175.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.3 p -69.78 -29.23 66.51 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.241 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.18 -151.69 20.86 Favored Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.544 -1.023 . . . . 0.0 110.544 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.5 30.54 Favored Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.889 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.986 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.375 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.515 ' SG ' ' HA ' ' A' ' 31' ' ' THR . 63.1 m . . . . . 0 N--CA 1.437 -1.121 0 CA-C-O 120.645 0.259 . . . . 0.0 110.77 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -64.19 152.31 41.08 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.902 0.881 . . . . 0.0 110.933 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.5 pt -65.9 152.36 9.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.381 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 73.41 9.65 5.08 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.928 0.891 . . . . 0.0 111.7 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -72.93 158.58 35.21 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.819 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -90.0 113.95 25.71 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.93 146.74 52.06 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-O 121.673 0.749 . . . . 0.0 110.558 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.08 -173.53 2.92 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -66.51 -49.77 65.43 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.283 0.564 . . . . 0.0 110.285 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -85.36 -27.17 26.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 110.315 -178.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.2 mp -98.67 79.03 2.4 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.005 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.404 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 8.7 p-10 -93.47 126.38 38.59 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -117.77 3.27 12.28 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.403 -176.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.1 m -130.83 149.75 52.32 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 121.792 -0.567 . . . . 0.0 110.862 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -51.79 -46.49 64.21 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.145 0.978 . . . . 0.0 112.4 -178.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -84.42 -3.55 58.4 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.986 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 74.6 mtt180 51.32 29.08 4.74 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.261 1.025 . . . . 0.0 112.416 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -94.77 126.54 40.15 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-O 122.205 1.002 . . . . 0.0 110.907 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -127.96 141.79 51.43 Favored 'General case' 0 C--N 1.257 -3.433 0 CA-C-N 113.68 -1.6 . . . . 0.0 108.237 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -82.51 -176.51 6.27 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -65.95 -11.24 46.03 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.12 4.09 31.02 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 122.31 -0.244 . . . . 0.0 110.941 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m120 76.26 22.3 1.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.683 0.793 . . . . 0.0 112.495 -178.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -96.79 131.37 43.58 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.4 t -62.71 131.19 48.11 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.707 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 m -102.34 167.13 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.69 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.311 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.1 mp -58.52 114.28 8.48 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -169.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.91 162.89 38.27 Favored 'Trans proline' 0 C--O 1.243 0.77 0 C-N-CA 123.351 2.701 . . . . 0.0 112.541 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.25 -30.98 71.49 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.86 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.515 ' HA ' ' SG ' ' A' ' 1' ' ' CYS . 31.1 m 74.96 107.31 0.07 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.199 1.399 . . . . 0.0 112.599 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.12 66.06 0.42 Allowed Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.11 -69.51 3.28 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.177 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 178.623 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.441 -0.913 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.96 133.4 56.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 118.156 0.434 . . . . 0.0 109.98 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.419 ' HA ' HD23 ' A' ' 4' ' ' HYP . 32.4 pt -45.9 134.97 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -173.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.455 ' HB3' ' HA ' ' A' ' 27' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -137.66 13.41 2.95 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 122.419 1.104 . . . . 0.0 109.328 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -90.03 140.8 29.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -72.0 141.42 49.36 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 123.282 0.364 . . . . 0.0 111.409 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.5 p -118.92 163.87 16.29 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 50.0 m-85 -134.96 158.58 43.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.48 -26.83 68.74 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.554 0.692 . . . . 0.0 110.246 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -110.86 16.17 21.43 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.334 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 9' ' ' PHE . 37.6 tp -142.27 104.84 4.5 Favored 'General case' 0 N--CA 1.426 -1.632 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.727 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -109.07 117.26 33.72 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.625 0.726 . . . . 0.0 110.153 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -132.68 27.96 4.3 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.66 163.65 13.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.885 -1.507 . . . . 0.0 111.998 -173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.5 m -83.99 -46.26 12.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.617 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 m -96.47 -3.96 42.45 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.761 -174.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 54.87 21.34 3.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -107.2 141.77 37.96 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.067 -175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.87 152.09 28.35 Favored 'General case' 0 C--N 1.283 -2.32 0 CA-C-N 114.893 -1.049 . . . . 0.0 108.847 176.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.41 -179.63 4.98 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 174.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -67.59 -7.25 24.79 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 123.026 0.53 . . . . 0.0 112.226 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -102.71 5.17 38.81 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.18 -179.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.3 t30 70.5 20.12 6.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 123.21 1.481 . . . . 0.0 110.622 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -100.02 153.24 19.36 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.612 -1.177 . . . . 0.0 108.133 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.78 129.08 36.23 Favored 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.455 ' HA ' ' HB3' ' A' ' 4' ' ' HYP . 22.6 m -130.83 149.99 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.656 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.5 tp -88.8 124.25 65.88 Favored Pre-proline 0 C--N 1.306 -1.307 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 172.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -74.71 -171.55 0.98 Allowed 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 122.029 1.819 . . . . 0.0 111.638 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -66.05 -23.98 66.64 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.246 0.546 . . . . 0.0 110.925 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.3 p -84.69 102.55 13.06 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 145.5 147.68 4.66 Favored Glycine 0 N--CA 1.431 -1.697 0 N-CA-C 110.214 -1.154 . . . . 0.0 110.214 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.89 -38.27 6.54 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.938 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.787 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.51 ' HD2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.73 166.46 13.05 Favored 'General case' 0 C--O 1.249 1.029 0 C-N-CA 120.824 -0.351 . . . . 0.0 110.435 173.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.8 pt -69.71 156.86 6.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.574 -178.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -87.7 1.09 54.7 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 121.822 -0.549 . . . . 0.0 111.298 -178.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.436 ' HG3' ' HB3' ' A' ' 2' ' ' ARG . 16.1 mm100 -75.95 152.97 36.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.053 0.454 . . . . 0.0 110.876 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -94.92 116.81 29.18 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.7 p -118.45 160.99 20.74 Favored 'General case' 0 C--N 1.275 -2.653 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.01 -176.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -134.52 155.47 50.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -63.77 -27.7 69.37 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.396 0.617 . . . . 0.0 111.764 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -98.31 16.25 22.08 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.649 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 47.2 tp -136.45 108.25 7.07 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-O 120.917 0.389 . . . . 0.0 110.092 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -82.61 73.89 9.62 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.676 1.227 . . . . 0.0 111.512 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.51 ' O ' ' HD2' ' A' ' 2' ' ' ARG . 33.8 t70 -95.39 -29.07 14.63 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 174.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.1 m -109.92 135.47 50.73 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.9 m -50.45 -47.41 56.85 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -94.32 2.58 55.83 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.882 -173.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 55.0 30.32 13.94 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.556 0.693 . . . . 0.0 110.974 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -84.92 116.12 23.17 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.457 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.4 m -129.36 145.61 51.37 Favored 'General case' 0 C--N 1.277 -2.562 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.167 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -83.51 -174.48 5.31 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -63.01 -16.42 59.75 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -102.61 12.17 36.75 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.306 3.3 p-10 50.46 36.91 14.4 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.894 1.678 . . . . 0.0 112.066 -175.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -91.3 153.97 19.57 Favored 'General case' 0 N--CA 1.424 -1.754 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 172.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.4 t -71.86 130.97 42.34 Favored 'General case' 0 C--N 1.286 -2.175 0 O-C-N 123.855 0.722 . . . . 0.0 112.01 -172.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.4 m -124.5 113.98 38.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.812 0.815 . . . . 0.0 110.262 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.402 HD13 ' HD2' ' A' ' 29' ' ' PRO . 26.4 tp -71.26 129.88 88.53 Favored Pre-proline 0 C--N 1.31 -1.139 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.352 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD2' HD13 ' A' ' 28' ' ' LEU . 10.5 Cg_endo -53.46 110.08 0.44 Allowed 'Trans proline' 0 C--N 1.367 1.512 0 C-N-CA 123.38 2.72 . . . . 0.0 112.218 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 60.2 18.22 7.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.73 1.212 . . . . 0.0 112.289 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 m 58.37 38.39 25.81 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-O 122.124 0.964 . . . . 0.0 109.542 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -151.06 94.85 0.15 Allowed Glycine 0 N--CA 1.435 -1.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.76 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.3 154.17 19.68 Favored Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.38 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 178.405 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.85 149.2 44.9 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.426 ' C ' ' H ' ' A' ' 5' ' ' ASN . 43.4 pt -66.47 148.47 12.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.936 -177.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.442 ' O ' ' HD3' ' A' ' 25' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.553 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.7 m-20 -140.02 7.73 2.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.958 1.303 . . . . 0.0 109.732 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -81.84 150.97 27.56 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -89.96 167.51 12.74 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.588 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.9 p -154.21 147.77 25.17 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.203 -176.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -135.29 175.63 9.41 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.1 -43.11 99.39 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.3 0.571 . . . . 0.0 109.471 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.64 -1.99 58.32 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.907 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.37 104.23 7.14 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 122.232 -0.292 . . . . 0.0 111.304 -177.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -101.27 91.33 4.46 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.43 0.633 . . . . 0.0 111.212 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -97.26 -13.47 21.97 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.395 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 26.6 m -76.9 141.03 40.71 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.361 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.5 m -51.76 -46.5 64.14 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.891 1.276 . . . . 0.0 112.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 t -112.42 20.62 16.51 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 55.91 17.76 2.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.532 1.133 . . . . 0.0 113.751 -177.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -85.19 115.51 23.02 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.1 t -125.64 138.04 53.9 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -93.33 176.76 6.27 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.498 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -69.81 -2.88 13.37 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.864 0.866 . . . . 0.0 112.366 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -99.33 6.19 46.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 64.39 34.77 10.16 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.957 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.553 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -132.74 144.39 50.25 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 85.5 m -64.69 131.46 46.95 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.71 135.75 53.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 175.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.7 tp -89.99 127.04 55.25 Favored Pre-proline 0 C--N 1.294 -1.816 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.565 -172.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.28 164.06 33.55 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 121.88 1.72 . . . . 0.0 109.772 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -73.73 -18.76 60.95 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 121.359 0.599 . . . . 0.0 111.559 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -94.41 6.38 48.92 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 121.659 0.742 . . . . 0.0 109.531 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -111.89 168.67 12.82 Favored Glycine 0 CA--C 1.505 -0.586 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.646 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 C--N 1.304 -1.203 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.588 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 179.673 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 85.9 m . . . . . 0 C--O 1.244 0.793 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -66.15 168.77 7.97 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.862 173.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 pt -82.58 147.78 5.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.61 -177.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . 0.439 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -114.55 -7.19 12.81 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.986 -177.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -89.5 155.35 19.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -83.51 141.07 31.89 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.1 p -127.61 159.9 33.24 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -132.63 170.44 15.2 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.14 -38.11 72.25 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 121.029 0.443 . . . . 0.0 111.364 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -96.81 1.68 50.99 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.96 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.75 88.98 2.81 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -110.86 119.9 40.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.373 -176.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -133.49 -4.26 2.96 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.513 0.673 . . . . 0.0 111.633 170.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.5 m -79.04 145.11 34.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 174.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.82 -46.16 67.61 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.649 0.738 . . . . 0.0 111.961 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -83.84 -17.26 41.55 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.611 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.6 22.09 10.73 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.626 0.77 . . . . 0.0 110.713 -174.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.69 141.81 33.05 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 113.558 0.948 . . . . 0.0 113.558 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -130.61 138.3 50.05 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 113.068 -1.878 . . . . 0.0 109.014 -178.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.424 HD21 HG11 ' A' ' 27' ' ' VAL . 9.4 p30 -98.24 -176.0 3.28 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.281 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -56.45 -28.52 59.81 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -178.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -81.49 2.0 30.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.072 0.463 . . . . 0.0 110.995 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 69.61 16.56 8.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.986 1.314 . . . . 0.0 110.634 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -97.68 159.55 14.86 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.032 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 49.1 t -72.34 145.04 48.05 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 124.031 0.832 . . . . 0.0 111.154 -175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.424 HG11 HD21 ' A' ' 21' ' ' ASN . 11.4 m -129.29 123.77 58.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 121.507 0.67 . . . . 0.0 110.326 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.97 154.91 84.85 Favored Pre-proline 0 C--N 1.308 -1.227 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.041 -174.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -70.43 164.74 34.1 Favored 'Trans proline' 0 C--O 1.249 1.059 0 C-N-CA 122.496 2.131 . . . . 0.0 110.476 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -68.29 -35.99 78.67 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 m -72.13 -39.56 68.72 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.975 0.417 . . . . 0.0 110.163 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.81 -154.8 34.44 Favored Glycine 0 C--O 1.244 0.774 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.53 29.79 0.13 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.419 -0.896 . . . . 0.0 113.729 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.782 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.802 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.438 -1.073 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -50.43 128.66 20.4 Favored 'General case' 0 C--O 1.254 1.304 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt . . . . . 0 C--O 1.236 0.388 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -164.876 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 4.1 p-10 . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -91.24 -177.28 4.83 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.816 -1.083 . . . . 0.0 108.527 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.435 ' HD2' ' HG2' ' A' ' 25' ' ' LYS . 14.5 mmmm -87.12 135.77 33.17 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.508 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 25.2 p -116.07 138.07 51.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.804 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -131.67 169.27 16.4 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -56.23 -47.02 79.31 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.448 0.468 . . . . 0.0 112.08 -177.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -102.41 12.02 37.15 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.091 0.472 . . . . 0.0 110.626 -173.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.26 99.86 9.23 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.59 101.89 11.01 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-O 121.347 0.594 . . . . 0.0 110.146 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.14 -52.8 1.04 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.462 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.0 m -70.16 115.95 9.95 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -177.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 73.4 m -59.36 -28.47 66.89 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -177.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.4 t -72.6 -35.98 68.0 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.248 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? 59.84 18.32 7.29 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.853 0.861 . . . . 0.0 111.086 -172.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -88.34 112.75 23.22 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.3 m -114.18 151.8 32.16 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 120.849 0.356 . . . . 0.0 111.054 -177.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 p30 -108.9 -176.56 3.07 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.18 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -60.37 -12.06 8.3 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 125.678 1.591 . . . . 0.0 114.119 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -104.17 7.07 36.09 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.3 m120 64.99 26.66 12.71 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.455 1.102 . . . . 0.0 110.269 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HG2' ' HD2' ' A' ' 7' ' ' LYS . 91.6 mttt -103.83 153.43 20.75 Favored 'General case' 0 N--CA 1.42 -1.953 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.15 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.5 m -79.93 145.01 32.86 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.19 164.99 23.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.5 175.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.59 131.15 84.75 Favored Pre-proline 0 C--N 1.309 -1.178 0 O-C-N 123.752 0.657 . . . . 0.0 110.597 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.88 178.68 7.12 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.489 2.126 . . . . 0.0 110.26 176.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.91 -23.38 41.85 Favored 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.5 m -64.45 -34.69 78.78 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.592 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.53 -148.61 18.71 Favored Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.601 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.2 60.82 0.6 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.001 0 C-N-CA 121.274 -0.489 . . . . 0.0 112.443 -178.655 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.6 t . . . . . 0 C--O 1.244 0.77 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.8 ttp180 -66.33 149.16 50.79 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.453 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.5 pt . . . . . 0 C--N 1.35 0.59 0 C-N-CA 124.607 1.163 . . . . 0.0 113.9 -175.285 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 . . . . . 0 CA--C 1.498 -1.03 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.677 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 15.5 mm100 -89.28 167.95 12.65 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.801 -178.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.51 148.18 22.9 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.638 174.687 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.4 p -137.83 133.52 34.05 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.245 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -137.32 177.16 8.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -71.58 -49.68 38.22 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.984 0.421 . . . . 0.0 110.493 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -88.04 -24.12 23.57 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.428 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.9 86.71 2.64 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -91.06 110.64 21.91 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.677 -176.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -112.72 -52.46 2.78 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.677 ' SG ' ' HB2' ' A' ' 6' ' ' GLN . 69.4 m -86.96 133.63 33.57 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.926 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -25.78 67.8 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.039 0.935 . . . . 0.0 112.138 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 p -78.16 -35.88 48.31 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.046 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 62.03 18.78 10.24 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.19 0.996 . . . . 0.0 110.814 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -86.33 101.39 13.05 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.6 m -108.53 145.65 34.45 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.945 -173.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 p30 -93.0 -178.07 4.69 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.562 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -67.71 -2.65 7.33 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.502 0.721 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -106.34 5.04 29.25 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 120.774 0.321 . . . . 0.0 110.222 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 65.88 24.15 11.29 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.873 0.869 . . . . 0.0 111.156 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -107.2 154.4 21.28 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.3 m -73.89 149.32 41.56 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.8 m -123.05 175.92 5.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.091 174.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.51 HD12 ' HD2' ' A' ' 29' ' ' PRO . 48.0 tp -57.71 119.87 36.89 Favored Pre-proline 0 C--N 1.323 -0.563 0 O-C-N 124.175 0.922 . . . . 0.0 111.391 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.51 ' HD2' HD12 ' A' ' 28' ' ' LEU . 63.2 Cg_endo -74.26 171.27 18.37 Favored 'Trans proline' 0 C--O 1.251 1.153 0 C-N-CA 122.721 2.281 . . . . 0.0 110.691 177.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -69.02 -15.95 63.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.078 0.466 . . . . 0.0 110.178 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.7 m 81.46 112.11 0.06 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.369 1.467 . . . . 0.0 111.941 176.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.27 67.49 0.43 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.47 -65.32 0.89 Allowed Glycine 0 C--N 1.308 -1.021 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.437 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.244 0.807 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -42.91 122.98 2.58 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 124.635 1.174 . . . . 0.0 111.943 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.5 pt . . . . . 0 C--N 1.318 -0.795 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.942 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.4 t30 . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 122.06 0.933 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -78.91 136.15 37.19 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 172.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -82.55 141.52 32.55 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.554 -1.258 . . . . 0.0 111.032 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.0 p -125.31 149.46 48.06 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.435 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 92.9 m-85 -125.97 177.07 6.55 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 87.4 mm-40 -58.16 -41.62 84.2 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -174.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -110.0 13.12 23.47 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.223 0.535 . . . . 0.0 110.634 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 7.7 mp -120.33 102.49 8.51 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.842 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -125.98 117.61 23.64 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.697 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -132.46 22.6 4.36 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 106.457 -1.682 . . . . 0.0 106.457 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.4 m -100.45 147.16 26.17 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.482 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.5 m -81.46 -37.89 27.26 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -80.64 -24.89 38.69 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.296 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.4 mtm-85 56.04 28.29 12.6 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.07 0.948 . . . . 0.0 110.943 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -109.66 125.35 52.51 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.515 -176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.1 m -117.88 139.19 51.47 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 p30 -89.43 -174.83 4.51 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 120.834 0.349 . . . . 0.0 110.907 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.4 ptt180 -62.86 -4.87 2.37 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.363 1.465 . . . . 0.0 114.033 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.96 16.3 15.12 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.157 -0.34 . . . . 0.0 110.552 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 65.8 19.14 11.31 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.204 0.526 . . . . 0.0 111.007 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -92.07 135.31 34.07 Favored 'General case' 0 N--CA 1.428 -1.567 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.0 t -70.93 134.16 47.0 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.8 m -119.65 150.28 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.425 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -77.33 143.45 69.03 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.224 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.425 ' HD2' HD12 ' A' ' 28' ' ' LEU . 40.3 Cg_exo -56.36 110.33 0.56 Allowed 'Trans proline' 0 C--O 1.243 0.728 0 C-N-CA 122.33 2.02 . . . . 0.0 110.397 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -83.54 -26.47 30.09 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 -175.236 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.3 m -81.48 -21.27 38.83 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 121.455 0.645 . . . . 0.0 109.678 -177.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.63 135.21 1.87 Allowed Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.704 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 122.96 2.29 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 119.937 -1.125 . . . . 0.0 112.775 177.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.388 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 177.816 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.915 0 CA-C-O 122.54 1.162 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -103.04 123.35 46.47 Favored 'General case' 0 C--N 1.275 -2.654 0 CA-C-N 112.709 -2.042 . . . . 0.0 105.558 177.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt . . . . . 0 C--O 1.245 0.847 0 O-C-N 123.648 0.592 . . . . 0.0 111.112 -179.175 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 CA--C 1.508 -0.648 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.59 162.34 13.34 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.504 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -84.38 132.68 34.56 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.684 0.615 . . . . 0.0 110.488 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -138.29 145.0 40.71 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-O 121.755 0.788 . . . . 0.0 110.661 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.67 -164.96 1.28 Allowed 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -72.33 -46.41 55.72 Favored 'General case' 0 N--CA 1.42 -1.931 0 CA-C-O 120.754 0.311 . . . . 0.0 111.157 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -105.28 -7.22 19.06 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 120.976 0.417 . . . . 0.0 112.098 -176.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mp -114.89 93.81 4.48 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -153.89 138.3 16.73 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -133.76 -0.15 3.18 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.812 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -70.11 131.59 44.52 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.219 -0.301 . . . . 0.0 110.533 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.8 m -58.63 -32.2 68.82 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.462 0.649 . . . . 0.0 110.032 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.25 -36.21 79.38 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.76 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.17 26.51 10.37 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.598 1.159 . . . . 0.0 111.745 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 59.1 tttp -126.34 132.19 51.64 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.1 m -119.96 142.8 48.43 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.203 0.314 . . . . 0.0 110.545 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -90.38 -179.19 5.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -58.47 -29.33 66.12 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -88.53 13.59 11.7 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.706 0.288 . . . . 0.0 111.292 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 m120 64.86 29.81 12.37 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -109.43 147.94 31.99 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.652 -0.819 . . . . 0.0 109.112 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 19' ' ' LYS . 59.7 m -62.7 142.59 58.05 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 124.07 0.856 . . . . 0.0 110.848 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.9 168.78 21.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -88.77 122.93 68.8 Favored Pre-proline 0 C--N 1.312 -1.037 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -81.65 -166.64 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.52 2.814 . . . . 0.0 110.236 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 mp0 -76.31 -33.19 59.04 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.9 p -77.75 -16.76 58.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.273 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.11 -147.16 23.4 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.335 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 115.89 54.1 0.36 Allowed Glycine 0 C--N 1.301 -1.389 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 C-N-CA 121.578 -0.344 . . . . 0.0 113.566 -176.391 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -57.79 141.34 49.21 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--N 1.307 -1.261 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.879 -176.98 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 t30 . . . . . 0 N--CA 1.485 1.299 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.96 145.02 52.03 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -77.45 139.46 39.66 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 p -119.95 133.81 55.44 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -125.33 143.03 51.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 121.254 0.549 . . . . 0.0 111.869 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.434 ' HG3' ' ND1' ' A' ' 11' ' ' HIS . 11.8 pt20 -61.85 -16.18 48.12 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.317 1.047 . . . . 0.0 113.797 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.434 ' ND1' ' HG3' ' A' ' 10' ' ' GLN . 76.1 m80 -112.5 13.72 20.16 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.023 -0.423 . . . . 0.0 111.938 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -121.82 165.19 16.25 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -115.0 30.66 7.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.649 0.738 . . . . 0.0 109.194 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -48.44 -52.53 21.69 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.019 1.328 . . . . 0.0 112.858 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 74.7 m -108.63 152.36 24.9 Favored 'General case' 0 C--N 1.278 -2.514 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.146 176.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -59.55 -45.63 91.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 t -108.37 -15.72 14.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.831 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 82.8 mtm180 49.35 51.01 17.13 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.505 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.45 100.82 4.61 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.7 m -96.55 130.43 43.73 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.02 -173.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.448 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.8 p30 -80.27 -175.87 5.32 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.465 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -67.51 -2.95 7.32 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -115.52 12.65 16.23 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.3 m120 63.66 23.57 13.58 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.944 0.878 . . . . 0.0 110.93 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' HD21 ' A' ' 21' ' ' ASN . 98.4 mttt -96.91 146.12 25.25 Favored 'General case' 0 N--CA 1.411 -2.375 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.129 174.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.3 t -84.71 143.52 29.13 Favored 'General case' 0 C--N 1.256 -3.488 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.448 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 m -125.25 136.48 60.71 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.075 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -55.9 147.33 43.83 Favored Pre-proline 0 C--O 1.244 0.777 0 O-C-N 123.656 0.598 . . . . 0.0 112.169 -174.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.87 136.63 43.54 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.257 2.638 . . . . 0.0 111.349 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -70.25 -9.89 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 p -77.47 -30.3 53.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 121.326 0.584 . . . . 0.0 110.017 172.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.67 168.15 31.04 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.575 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.57 173.86 13.18 Favored Glycine 0 N--CA 1.427 -1.915 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.147 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.108 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 178.401 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.564 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 tpp180 -67.03 127.93 34.45 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 173.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 pt . . . . . 0 C--N 1.311 -1.104 0 O-C-N 123.951 0.782 . . . . 0.0 111.659 -178.69 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 . . . . . 0 N--CA 1.486 1.331 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -79.63 151.88 30.32 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mmmp? -74.46 130.55 39.83 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.069 0.461 . . . . 0.0 112.098 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.452 ' HA ' HD23 ' A' ' 12' ' ' LEU . 26.4 p -114.54 159.04 20.85 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 175.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -146.0 163.48 35.06 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 -177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -75.44 -15.74 60.4 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.162 0.506 . . . . 0.0 112.216 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -101.56 12.13 37.78 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.691 0.757 . . . . 0.0 110.091 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 8' ' ' CYS . 33.9 tp -120.03 149.61 41.88 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.23 19.44 2.77 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.509 -1.276 . . . . 0.0 112.369 -174.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.564 ' HB3' ' HB2' ' A' ' 2' ' ' ARG . 7.9 m-20 -67.71 -17.07 64.44 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.0 m -85.76 110.36 19.29 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.5 m -53.33 -44.78 68.73 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.6 t -102.56 9.88 39.16 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.475 0.655 . . . . 0.0 110.139 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' ARG . 4.5 mpt_? 59.08 31.25 21.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.104 0.962 . . . . 0.0 111.63 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.45 120.14 25.09 Favored 'General case' 0 CA--C 1.501 -0.927 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.254 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.5 m -131.02 148.93 52.81 Favored 'General case' 0 C--N 1.275 -2.67 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.594 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -88.41 176.92 6.98 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -66.39 -15.14 63.07 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -95.89 6.19 49.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 120.734 0.302 . . . . 0.0 111.122 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 71.69 32.66 1.93 Allowed 'General case' 0 C--O 1.26 1.619 0 C-N-CA 123.877 0.871 . . . . 0.0 112.185 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.82 149.25 25.22 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 172.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 21.2 t -78.93 135.15 36.88 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 m -118.21 145.28 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 CA-C-O 120.958 0.408 . . . . 0.0 110.436 177.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.474 HD12 ' HD2' ' A' ' 29' ' ' PRO . 29.2 tp -67.82 127.28 93.35 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.921 -171.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.474 ' HD2' HD12 ' A' ' 28' ' ' LEU . 78.3 Cg_endo -82.83 175.87 8.24 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.773 2.315 . . . . 0.0 111.42 175.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -92.12 -48.26 6.81 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.154 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.7 m -59.94 -48.32 82.17 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -115.52 149.59 18.82 Favored Glycine 0 N--CA 1.434 -1.44 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.549 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.24 -27.78 5.18 Favored Glycine 0 C--N 1.306 -1.092 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.774 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 CA-C-O 121.505 0.503 . . . . 0.0 111.986 -178.018 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 122.309 1.052 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.491 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 17.6 tpp180 -100.01 139.19 36.04 Favored 'General case' 0 C--N 1.273 -2.755 0 CA-C-N 113.823 -1.535 . . . . 0.0 106.914 168.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.8 pt . . . . . 0 C--O 1.246 0.909 0 O-C-N 123.267 0.354 . . . . 0.0 110.701 177.663 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -84.06 158.38 21.46 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -80.74 126.08 30.86 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 120.736 0.303 . . . . 0.0 110.46 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 p -131.12 138.59 49.58 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -129.95 175.77 8.6 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -64.16 -19.93 65.65 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -118.22 13.47 13.74 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.399 0.619 . . . . 0.0 110.045 175.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -135.21 35.07 3.03 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.467 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 11.1 m-20 -79.44 87.59 5.06 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.802 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -87.78 -12.71 44.29 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.797 0.808 . . . . 0.0 109.814 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.491 ' SG ' ' HB3' ' A' ' 2' ' ' ARG . 29.7 m -81.16 118.22 22.37 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 173.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.6 m -63.86 -32.84 74.49 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -169.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -81.86 -7.94 59.64 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.592 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.467 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 77.6 mtp180 57.52 28.54 15.7 Favored 'General case' 0 C--N 1.358 0.936 0 C-N-CA 124.877 1.271 . . . . 0.0 111.413 -176.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.6 tttm -83.16 100.53 10.61 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -128.1 144.79 51.13 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.651 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -89.39 -179.1 5.76 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 120.964 0.412 . . . . 0.0 111.301 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -63.47 -18.07 63.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -93.58 5.24 52.27 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.134 0.492 . . . . 0.0 109.717 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 68.52 24.39 7.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.306 1.043 . . . . 0.0 110.882 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -97.11 135.83 38.52 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.3 t -68.05 135.98 53.1 Favored 'General case' 0 C--N 1.287 -2.145 0 O-C-N 123.559 0.537 . . . . 0.0 109.653 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.2 m -117.62 143.03 29.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 CA-C-O 120.601 0.239 . . . . 0.0 110.544 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.414 HD12 ' HD2' ' A' ' 29' ' ' PRO . 35.4 tp -67.48 125.51 91.27 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.845 -172.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.414 ' HD2' HD12 ' A' ' 28' ' ' LEU . 6.7 Cg_exo -69.11 107.87 1.83 Allowed 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.672 2.248 . . . . 0.0 108.72 170.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -15.62 62.2 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.252 0.549 . . . . 0.0 112.056 -174.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -112.51 9.52 19.56 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.037 0.922 . . . . 0.0 108.936 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -145.23 -133.54 2.61 Favored Glycine 0 N--CA 1.435 -1.37 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -157.89 152.14 23.34 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.489 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.034 -178.132 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' HG ' ' A' ' 28' ' ' LEU . 33.6 m . . . . . 0 N--CA 1.443 -0.812 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.4 HH21 ' CG ' ' A' ' 14' ' ' ASP . 4.1 tpp180 -62.11 136.28 57.88 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 173.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 pt . . . . . 0 C--O 1.254 1.342 0 O-C-N 123.753 0.658 . . . . 0.0 111.941 178.764 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 120.704 0.288 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -76.09 164.65 25.91 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 27.6 mtpp -78.38 171.23 15.39 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.137 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -117.83 133.46 55.91 Favored 'General case' 0 C--N 1.285 -2.225 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -125.53 160.55 29.26 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -62.14 -25.57 67.82 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 123.489 0.716 . . . . 0.0 112.462 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -101.92 6.23 41.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.702 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.7 tp -97.65 95.16 7.4 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.236 0.541 . . . . 0.0 110.175 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -97.02 10.89 37.98 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.539 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.4 ' CG ' HH21 ' A' ' 2' ' ' ARG . 14.1 t70 -78.41 -23.79 46.55 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.448 1.118 . . . . 0.0 108.443 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.1 m -79.88 107.49 12.7 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 170.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.3 m -52.31 -47.09 66.14 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.716 0.635 . . . . 0.0 112.665 -169.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.7 m -98.85 4.83 47.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.771 -177.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 53.37 30.78 10.82 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.449 0.7 . . . . 0.0 110.358 -175.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -83.26 130.72 35.09 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.112 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 63.7 m -120.17 151.68 38.76 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.217 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' LYS . 39.5 p30 -99.89 -176.16 3.17 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 174.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -62.61 -11.92 19.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.9 12.03 29.29 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 121.888 -0.507 . . . . 0.0 110.745 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 66.28 25.13 10.56 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 122.136 0.969 . . . . 0.0 108.95 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 68.3 mttm -93.81 160.4 14.76 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.572 176.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -84.67 143.93 28.9 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.0 m -140.22 154.2 22.77 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 CA-C-O 120.97 0.414 . . . . 0.0 110.036 175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.436 ' HG ' ' HB2' ' A' ' 1' ' ' CYS . 7.8 mp -90.29 154.73 46.85 Favored Pre-proline 0 C--N 1.305 -1.365 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.06 179.95 5.26 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 122.291 1.994 . . . . 0.0 111.01 174.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.56 -32.16 73.08 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 122.79 0.436 . . . . 0.0 111.412 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.9 p -83.58 2.73 35.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.59 -113.29 4.17 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.366 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.14 170.9 29.69 Favored Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.304 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 179.335 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.955 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -46.87 123.59 5.34 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.552 1.141 . . . . 0.0 110.612 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt . . . . . 0 C--N 1.321 -0.642 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -174.927 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 C--O 1.234 0.248 0 CA-C-O 122.238 1.018 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -83.83 168.34 16.22 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.309 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -86.83 132.37 33.85 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.663 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 27.7 p -115.0 141.55 47.84 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -148.08 157.26 43.41 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.57 -35.64 80.14 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.187 0.518 . . . . 0.0 111.241 -176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.0 p-80 -95.89 11.28 34.37 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.882 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.8 tp -114.4 111.97 22.28 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 121.663 0.744 . . . . 0.0 109.086 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -94.86 15.72 17.84 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.704 -174.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -60.79 -48.79 80.22 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.721 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.0 m -90.24 127.4 36.13 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.78 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.4 m -50.55 -42.2 55.08 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 125.832 1.653 . . . . 0.0 112.687 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 29' ' ' PRO . 29.9 p -83.66 -23.13 31.91 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? 61.61 16.39 7.66 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.18 0.592 . . . . 0.0 110.86 -172.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 13.7 mmmm -90.74 150.71 21.51 Favored 'General case' 0 CA--C 1.48 -1.73 0 O-C-N 122.086 -0.384 . . . . 0.0 110.98 -177.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.4 m -127.09 142.57 51.49 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-N 114.556 -1.202 . . . . 0.0 112.277 -173.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.453 HD21 ' HB2' ' A' ' 25' ' ' LYS . 33.5 p30 -104.31 -177.66 3.43 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.324 174.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -62.64 -15.22 50.93 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -100.18 5.59 44.77 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 121.998 -0.439 . . . . 0.0 111.487 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 t30 71.64 17.04 5.66 Favored 'General case' 0 N--CA 1.505 2.317 0 CA-C-O 123.394 1.568 . . . . 0.0 108.9 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.9 mttm -94.53 158.32 15.59 Favored 'General case' 0 N--CA 1.415 -2.213 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.297 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.663 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.0 m -74.51 150.88 39.62 Favored 'General case' 0 C--N 1.281 -2.407 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.123 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' LYS . 3.0 m -130.57 116.96 37.26 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.348 0.594 . . . . 0.0 109.477 170.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 24.6 tp -90.29 142.68 28.61 Favored Pre-proline 0 C--N 1.289 -2.031 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 17' ' ' SER . 85.0 Cg_exo -51.77 154.61 9.3 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 123.099 2.532 . . . . 0.0 113.028 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.46 -22.93 35.0 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.4 p -77.85 87.89 4.06 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 123.95 -97.25 0.55 Allowed Glycine 0 N--CA 1.423 -2.223 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.99 -13.83 63.62 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 121.212 -0.518 . . . . 0.0 113.602 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.18 0 C-N-CA 121.37 -0.443 . . . . 0.0 112.747 -176.767 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.435 -1.222 0 CA-C-O 121.224 0.535 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -69.68 135.39 49.8 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.507 HG13 ' HG2' ' A' ' 6' ' ' GLN . 30.0 pt . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 . . . . . 0 C--O 1.238 0.479 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.507 ' HG2' HG13 ' A' ' 3' ' ' ILE . 84.3 mm-40 -83.4 152.07 25.2 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 120.647 0.261 . . . . 0.0 110.418 177.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.42 122.51 27.59 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.392 178.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 26' ' ' CYS . 25.3 p -129.15 155.75 45.0 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -122.37 -174.31 2.88 Favored 'General case' 0 C--N 1.293 -1.863 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.298 -176.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -69.41 -40.02 77.58 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -175.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -105.38 -21.55 13.21 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.302 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 mp -114.09 103.6 11.29 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.068 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.466 ' OD1' ' HA ' ' A' ' 18' ' ' ARG . 1.6 p30 -148.93 163.0 38.74 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -133.1 31.44 3.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.2 m -95.92 139.06 32.67 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.883 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 m -60.3 -37.97 82.19 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 121.549 0.69 . . . . 0.0 110.651 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -85.97 -10.32 55.33 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.72 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.466 ' HA ' ' OD1' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 62.07 17.86 9.47 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.583 1.153 . . . . 0.0 110.949 -174.733 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -105.18 140.94 37.58 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 121.774 0.797 . . . . 0.0 112.233 -173.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.7 m -131.2 147.87 52.64 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -84.52 -175.27 5.71 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 118.476 0.58 . . . . 0.0 110.001 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -68.63 -8.23 40.26 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -103.46 7.16 37.93 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m120 63.58 32.15 14.21 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 124.024 0.929 . . . . 0.0 112.295 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -92.33 138.48 31.48 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 174.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.459 ' HA ' ' SG ' ' A' ' 8' ' ' CYS . 42.5 t -62.76 113.98 3.35 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 124.024 0.827 . . . . 0.0 110.712 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . 0.255 24.8 m -105.24 102.69 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 CA-C-O 122.842 1.306 . . . . 0.0 112.374 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.21 155.77 91.51 Favored Pre-proline 0 C--N 1.3 -1.55 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.674 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -75.47 174.09 13.39 Favored 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 120.876 1.051 . . . . 0.0 109.938 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -66.93 -29.91 69.91 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.672 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -63.72 -25.09 68.04 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.062 176.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.37 -137.21 34.96 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 128.99 -164.94 21.94 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.239 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 177.4 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.3 ttm-85 -51.6 124.65 12.71 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 119.457 1.026 . . . . 0.0 112.144 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.0 -178.79 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 . . . . . 0 N--CA 1.484 1.257 0 CA-C-O 121.271 0.558 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -69.55 153.78 42.97 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -77.92 159.31 28.95 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.492 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 18.0 p -123.26 150.98 42.82 Favored 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 112.943 -1.935 . . . . 0.0 106.009 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.4 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 90.1 m-85 -126.48 174.05 8.93 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -59.02 -44.88 91.77 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 123.833 0.708 . . . . 0.0 111.463 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -118.43 -30.68 5.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.808 175.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 6.9 mp -77.78 92.37 4.19 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.873 0.844 . . . . 0.0 111.521 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -127.42 118.2 23.62 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.082 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -123.79 12.98 9.21 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 122.861 1.315 . . . . 0.0 107.931 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m -83.86 111.1 18.91 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 m -57.38 -26.14 60.59 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 123.477 0.711 . . . . 0.0 111.786 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 p -71.45 -27.87 63.56 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.427 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 54.8 21.84 3.83 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 125.077 1.351 . . . . 0.0 113.361 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -119.88 125.22 47.97 Favored 'General case' 0 N--CA 1.415 -2.205 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.407 ' SG ' ' HA ' ' A' ' 24' ' ' ASN . 42.6 t -130.67 142.9 50.44 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.9 p30 -90.01 178.2 6.26 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 120.975 0.417 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -64.26 -18.67 64.78 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -88.62 0.97 55.84 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.675 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.407 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 4.6 m-20 73.74 27.67 1.7 Allowed 'General case' 0 C--O 1.246 0.894 0 C-N-CA 124.15 0.98 . . . . 0.0 111.454 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -106.6 129.72 54.48 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 71.1 m -70.38 135.35 48.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.7 m -123.02 150.98 27.09 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.357 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.0 tp -90.01 141.32 27.9 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 -176.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.55 175.64 8.47 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 121.775 1.65 . . . . 0.0 112.627 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -28.93 70.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.476 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -78.28 -3.08 41.1 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.855 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.33 -145.68 29.58 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.795 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 146.55 140.26 3.43 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.538 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.437 -1.125 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -61.46 130.89 48.2 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 117.71 0.232 . . . . 0.0 110.384 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.49 HD13 ' H ' ' A' ' 3' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.241 0.649 0 O-C-N 124.043 0.839 . . . . 0.0 113.096 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.2 m120 . . . . . 0 CA--C 1.491 -1.289 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.436 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.3 mm-40 -99.09 175.59 5.85 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.985 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 150.17 21.81 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.281 -178.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.2 p -147.16 161.22 41.34 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.488 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 91.8 m-85 -134.06 -170.86 2.6 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -70.04 -49.4 51.66 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -103.11 -4.04 25.04 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.923 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 79.9 mt -99.92 94.03 6.08 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.408 ' HB3' ' HG2' ' A' ' 18' ' ' ARG . 11.5 m-20 -95.36 80.14 3.5 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.515 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.57 -49.21 56.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.68 0.753 . . . . 0.0 109.171 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -80.06 141.94 35.38 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.125 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.19 -21.84 62.1 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 124.183 0.993 . . . . 0.0 110.513 -175.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.7 p -70.24 -28.08 64.97 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.308 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HG2' ' HB3' ' A' ' 13' ' ' ASP . 76.7 mtp180 57.0 26.88 12.43 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.489 1.116 . . . . 0.0 111.49 -177.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -121.08 120.58 35.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.039 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.4 m -109.69 151.43 26.9 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.16 -178.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -103.16 -173.75 2.39 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -68.22 -11.33 59.12 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -94.06 1.67 56.15 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 68.13 22.44 8.31 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 122.403 1.097 . . . . 0.0 110.368 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -106.7 163.74 12.66 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.282 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.7 m -79.86 148.57 31.28 Favored 'General case' 0 C--N 1.284 -2.264 0 O-C-N 123.433 0.458 . . . . 0.0 110.779 -177.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.1 m -126.4 170.52 16.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.324 173.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.87 131.29 70.65 Favored Pre-proline 0 N--CA 1.434 -1.266 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.53 159.67 28.73 Favored 'Trans proline' 0 N--CA 1.444 -1.416 0 C-N-CA 122.154 1.903 . . . . 0.0 110.784 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.87 -16.98 62.15 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.738 0.78 . . . . 0.0 110.066 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.6 p -81.22 -0.32 40.07 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.81 -90.49 1.66 Allowed Glycine 0 N--CA 1.431 -1.667 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 88.73 -174.91 43.29 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.485 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.575 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.853 0.835 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.18 140.35 30.23 Favored 'General case' 0 C--N 1.264 -3.123 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.559 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 12.8 pt . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.675 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 . . . . . 0 CA--C 1.512 -0.498 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.48 141.97 51.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.75 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.517 ' N ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -67.86 145.66 54.41 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 167.661 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -115.94 145.29 43.05 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 117.443 -1.703 . . . . 0.0 113.382 -176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -137.39 133.36 34.7 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -55.26 -33.7 63.4 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -99.96 5.89 45.19 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.6 mt -91.34 139.73 30.45 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.533 -0.867 . . . . 0.0 111.444 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -82.71 -8.6 59.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.723 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -52.17 -39.44 60.06 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.329 1.052 . . . . 0.0 109.484 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 59.1 m -92.65 99.54 12.22 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.402 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.3 m -58.4 -37.4 75.24 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.49 0.662 . . . . 0.0 109.916 176.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 m -75.92 -23.72 55.49 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.8 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 53.14 23.23 2.95 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.292 1.037 . . . . 0.0 113.371 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.43 140.44 49.14 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -128.23 151.97 48.64 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.869 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -94.94 174.95 6.84 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -64.03 -12.25 36.76 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -99.86 9.95 42.14 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 122.439 -0.163 . . . . 0.0 111.288 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 t30 72.3 17.22 4.93 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 124.403 1.081 . . . . 0.0 111.269 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -93.38 146.88 23.41 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.1 t -87.97 112.52 22.66 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.3 m -102.2 162.96 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 121.392 0.615 . . . . 0.0 112.29 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.03 139.32 79.58 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.56 156.32 42.72 Favored 'Trans proline' 0 C--O 1.24 0.577 0 C-N-CA 122.304 2.003 . . . . 0.0 110.539 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.09 -20.7 62.32 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.702 0.287 . . . . 0.0 111.385 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -88.4 -9.44 52.61 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.924 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 116.61 -143.4 18.04 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.815 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.42 -148.85 19.2 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.453 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.49 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.291 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' HD3' ' A' ' 29' ' ' PRO . 18.3 t . . . . . 0 C--O 1.247 0.957 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -59.52 178.43 0.15 Allowed 'General case' 0 C--O 1.251 1.16 0 CA-C-O 122.312 1.053 . . . . 0.0 111.566 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.462 HG13 ' HG2' ' A' ' 6' ' ' GLN . 15.6 pt . . . . . 0 C--N 1.295 -1.764 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 . . . . . 0 N--CA 1.442 -0.859 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.462 ' HG2' HG13 ' A' ' 3' ' ' ILE . 15.8 mm100 -64.42 142.18 58.51 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -93.03 124.14 36.79 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.28 151.08 52.0 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -128.75 -165.38 1.5 Allowed 'General case' 0 C--N 1.285 -2.202 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -73.74 -49.74 24.08 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.615 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -90.68 -29.91 17.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.251 0.548 . . . . 0.0 110.345 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.27 82.43 5.46 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.49 ' CG ' ' HG2' ' A' ' 18' ' ' ARG . 13.2 t70 -105.79 137.13 44.19 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.57 -178.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -128.91 -0.35 5.32 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.488 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 64.0 m -95.48 177.23 5.89 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.472 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -80.38 -33.38 37.21 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.819 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 m -134.89 24.46 3.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.607 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HG2' ' CG ' ' A' ' 13' ' ' ASP . 58.9 mtm180 50.12 24.57 1.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 124.07 0.948 . . . . 0.0 112.808 -175.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -85.2 107.58 17.32 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.914 0.864 . . . . 0.0 111.821 -177.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 m -117.92 136.48 53.45 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.574 -1.648 . . . . 0.0 108.819 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -81.05 -177.73 6.57 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 120.757 0.313 . . . . 0.0 110.947 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.46 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -56.31 -21.0 21.38 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -101.39 7.61 42.57 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.913 -0.492 . . . . 0.0 110.456 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.0 m120 66.23 25.67 10.55 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 123.943 0.897 . . . . 0.0 112.786 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -90.38 142.3 27.87 Favored 'General case' 0 N--CA 1.422 -1.828 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.556 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.4 t -67.07 125.46 26.07 Favored 'General case' 0 C--N 1.286 -2.155 0 O-C-N 124.654 1.221 . . . . 0.0 109.317 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.9 m -115.03 176.08 2.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-O 120.997 0.427 . . . . 0.0 111.008 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.61 148.7 87.95 Favored Pre-proline 0 C--N 1.303 -1.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.029 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 1' ' ' CYS . 61.0 Cg_endo -74.42 172.26 16.47 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.656 2.238 . . . . 0.0 112.241 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -103.81 -26.04 12.86 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.646 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 m -85.18 -48.21 9.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.483 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -93.74 -178.41 39.41 Favored Glycine 0 C--O 1.244 0.725 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.915 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.62 -69.59 0.98 Allowed Glycine 0 C--O 1.243 0.688 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.511 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.258 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -58.97 160.98 5.37 Favored 'General case' 0 C--O 1.249 1.028 0 C-N-CA 123.061 0.544 . . . . 0.0 111.069 175.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 pt . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.017 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 CA--C 1.502 -0.894 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -79.06 147.45 32.8 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.812 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.462 ' O ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -88.9 149.11 23.49 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 176.617 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.3 p -145.1 141.5 28.87 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -119.46 172.05 7.91 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -54.23 -41.51 68.8 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -105.78 3.58 28.97 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.446 0.641 . . . . 0.0 110.798 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.4 mt -124.11 75.01 1.34 Allowed 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.082 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.407 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 8.2 m-20 -100.24 113.84 26.83 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.008 -178.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -113.1 -10.37 13.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.584 0.706 . . . . 0.0 110.161 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.4 m -71.9 139.46 48.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -54.18 -46.21 72.31 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.951 0.9 . . . . 0.0 111.711 -175.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t -101.33 13.69 34.3 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.407 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 83.3 mtp180 51.65 30.89 7.13 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.345 1.058 . . . . 0.0 112.023 -176.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -94.01 113.71 25.75 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.5 -172.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -125.11 136.55 53.75 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -85.37 -171.75 3.78 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.989 0.423 . . . . 0.0 111.788 -178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -66.83 -10.1 44.45 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.466 0.706 . . . . 0.0 112.785 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -108.15 11.03 27.84 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.48 25.18 15.0 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.536 0.735 . . . . 0.0 111.445 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -94.71 145.69 24.68 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -71.5 135.79 47.28 Favored 'General case' 0 C--N 1.283 -2.29 0 O-C-N 124.572 1.17 . . . . 0.0 108.417 -177.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.1 m -129.72 137.06 57.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 121.385 0.612 . . . . 0.0 111.523 178.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.457 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -73.07 128.11 88.32 Favored Pre-proline 0 C--N 1.305 -1.368 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 176.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 28' ' ' LEU . 18.8 Cg_endo -58.87 161.23 15.87 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.562 2.175 . . . . 0.0 111.823 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.42 -9.22 55.81 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.859 -175.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.3 p -69.78 -29.23 66.51 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.241 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.18 -151.69 20.86 Favored Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.544 -1.023 . . . . 0.0 110.544 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.5 30.54 Favored Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.889 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.986 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.375 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.516 ' SG ' ' HA ' ' A' ' 31' ' ' THR . 63.1 m . . . . . 0 N--CA 1.437 -1.121 0 CA-C-O 120.645 0.259 . . . . 0.0 110.77 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -64.19 152.31 41.08 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.902 0.881 . . . . 0.0 110.933 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.5 pt . . . . . 0 C--N 1.316 -0.857 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.381 175.872 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 121.028 0.442 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -72.93 158.58 35.21 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.819 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -90.0 113.95 25.71 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.93 146.74 52.06 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-O 121.673 0.749 . . . . 0.0 110.558 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.08 -173.53 2.92 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -66.51 -49.77 65.43 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.283 0.564 . . . . 0.0 110.285 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -85.36 -27.17 26.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 110.315 -178.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.2 mp -98.67 79.03 2.4 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.005 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 8.7 p-10 -93.47 126.38 38.59 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -117.77 3.27 12.28 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.403 -176.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.1 m -130.83 149.75 52.32 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 121.792 -0.567 . . . . 0.0 110.862 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -51.79 -46.49 64.21 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.145 0.978 . . . . 0.0 112.4 -178.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -84.42 -3.55 58.4 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.986 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.44 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 74.6 mtt180 51.32 29.08 4.74 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.261 1.025 . . . . 0.0 112.416 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HE2' HG23 ' A' ' 27' ' ' VAL . 19.4 ptmt -94.77 126.54 40.15 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-O 122.205 1.002 . . . . 0.0 110.907 -176.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -127.96 141.79 51.43 Favored 'General case' 0 C--N 1.257 -3.433 0 CA-C-N 113.68 -1.6 . . . . 0.0 108.237 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -82.51 -176.51 6.27 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -65.95 -11.24 46.03 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.12 4.09 31.02 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 122.31 -0.244 . . . . 0.0 110.941 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m120 76.26 22.3 1.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.683 0.793 . . . . 0.0 112.495 -178.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -96.79 131.37 43.58 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.4 t -62.71 131.19 48.11 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.707 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.456 HG23 ' HE2' ' A' ' 19' ' ' LYS . 1.8 m -102.34 167.13 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.69 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.311 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 28' ' ' LEU . 5.1 mp -58.52 114.28 8.48 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -169.067 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.91 162.89 38.27 Favored 'Trans proline' 0 C--O 1.243 0.77 0 C-N-CA 123.351 2.701 . . . . 0.0 112.541 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.25 -30.98 71.49 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.86 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.516 ' HA ' ' SG ' ' A' ' 1' ' ' CYS . 31.1 m 74.96 107.31 0.07 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.199 1.399 . . . . 0.0 112.599 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.12 66.06 0.42 Allowed Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.11 -69.51 3.28 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.177 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 178.623 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.441 -0.913 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.96 133.4 56.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 118.156 0.434 . . . . 0.0 109.98 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.4 pt . . . . . 0 CA--C 1.559 1.316 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -173.62 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.8 t30 . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 122.419 1.104 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -90.03 140.8 29.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -72.0 141.42 49.36 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 123.282 0.364 . . . . 0.0 111.409 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.5 p -118.92 163.87 16.29 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.526 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 50.0 m-85 -134.96 158.58 43.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.48 -26.83 68.74 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.554 0.692 . . . . 0.0 110.246 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -110.86 16.17 21.43 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.334 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.526 ' HB3' ' HB2' ' A' ' 9' ' ' PHE . 37.6 tp -142.27 104.84 4.5 Favored 'General case' 0 N--CA 1.426 -1.632 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.727 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -109.07 117.26 33.72 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.625 0.726 . . . . 0.0 110.153 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -132.68 27.96 4.3 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.66 163.65 13.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.885 -1.507 . . . . 0.0 111.998 -173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.5 m -83.99 -46.26 12.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.617 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 m -96.47 -3.96 42.45 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.761 -174.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 54.87 21.34 3.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -107.2 141.77 37.96 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.067 -175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.87 152.09 28.35 Favored 'General case' 0 C--N 1.283 -2.32 0 CA-C-N 114.893 -1.049 . . . . 0.0 108.847 176.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.41 -179.63 4.98 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 174.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -67.59 -7.25 24.79 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 123.026 0.53 . . . . 0.0 112.226 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -102.71 5.17 38.81 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.18 -179.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.3 t30 70.5 20.12 6.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 123.21 1.481 . . . . 0.0 110.622 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -100.02 153.24 19.36 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.612 -1.177 . . . . 0.0 108.133 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.78 129.08 36.23 Favored 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.6 m -130.83 149.99 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.656 -177.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.5 tp -88.8 124.25 65.88 Favored Pre-proline 0 C--N 1.306 -1.307 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 172.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -74.71 -171.55 0.98 Allowed 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 122.029 1.819 . . . . 0.0 111.638 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -66.05 -23.98 66.64 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.246 0.546 . . . . 0.0 110.925 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.3 p -84.69 102.55 13.06 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 145.5 147.68 4.66 Favored Glycine 0 N--CA 1.431 -1.697 0 N-CA-C 110.214 -1.154 . . . . 0.0 110.214 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.89 -38.27 6.54 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.938 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.787 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.521 ' HD2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.73 166.46 13.05 Favored 'General case' 0 C--O 1.249 1.029 0 C-N-CA 120.824 -0.351 . . . . 0.0 110.435 173.849 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.8 pt . . . . . 0 CA--C 1.543 0.699 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.574 -178.516 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 . . . . . 0 CA--C 1.514 -0.415 0 CA-C-O 120.768 0.318 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.517 ' HG3' ' HB3' ' A' ' 2' ' ' ARG . 16.1 mm100 -75.95 152.97 36.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.053 0.454 . . . . 0.0 110.876 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -94.92 116.81 29.18 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.7 p -118.45 160.99 20.74 Favored 'General case' 0 C--N 1.275 -2.653 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.01 -176.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -134.52 155.47 50.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -63.77 -27.7 69.37 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.396 0.617 . . . . 0.0 111.764 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -98.31 16.25 22.08 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.649 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 47.2 tp -136.45 108.25 7.07 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-O 120.917 0.389 . . . . 0.0 110.092 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -82.61 73.89 9.62 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.676 1.227 . . . . 0.0 111.512 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.521 ' O ' ' HD2' ' A' ' 2' ' ' ARG . 33.8 t70 -95.39 -29.07 14.63 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 174.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.1 m -109.92 135.47 50.73 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.9 m -50.45 -47.41 56.85 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -94.32 2.58 55.83 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.882 -173.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 55.0 30.32 13.94 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.556 0.693 . . . . 0.0 110.974 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -84.92 116.12 23.17 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.457 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 24' ' ' ASN . 63.4 m -129.36 145.61 51.37 Favored 'General case' 0 C--N 1.277 -2.562 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.167 -177.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.402 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.2 p30 -83.51 -174.48 5.31 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -63.01 -16.42 59.75 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -102.61 12.17 36.75 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 20' ' ' CYS 0.306 3.3 p-10 50.46 36.91 14.4 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.894 1.678 . . . . 0.0 112.066 -175.673 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.8 mttm -91.3 153.97 19.57 Favored 'General case' 0 N--CA 1.424 -1.754 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.4 t -71.86 130.97 42.34 Favored 'General case' 0 C--N 1.286 -2.175 0 O-C-N 123.855 0.722 . . . . 0.0 112.01 -172.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.4 m -124.5 113.98 38.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.812 0.815 . . . . 0.0 110.262 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.4 tp -71.26 129.88 88.53 Favored Pre-proline 0 C--N 1.31 -1.139 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.352 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.478 ' HD2' HD12 ' A' ' 28' ' ' LEU . 10.5 Cg_endo -53.46 110.08 0.44 Allowed 'Trans proline' 0 C--N 1.367 1.512 0 C-N-CA 123.38 2.72 . . . . 0.0 112.218 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 60.2 18.22 7.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.73 1.212 . . . . 0.0 112.289 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 m 58.37 38.39 25.81 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-O 122.124 0.964 . . . . 0.0 109.542 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -151.06 94.85 0.15 Allowed Glycine 0 N--CA 1.435 -1.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.76 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.3 154.17 19.68 Favored Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.38 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 178.405 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.85 149.2 44.9 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.4 pt . . . . . 0 C--N 1.311 -1.076 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.936 -177.184 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.7 m-20 . . . . . 0 N--CA 1.472 0.639 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -81.84 150.97 27.56 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -89.96 167.51 12.74 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.588 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.9 p -154.21 147.77 25.17 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.203 -176.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -135.29 175.63 9.41 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.1 -43.11 99.39 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.3 0.571 . . . . 0.0 109.471 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.64 -1.99 58.32 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.907 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.37 104.23 7.14 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 122.232 -0.292 . . . . 0.0 111.304 -177.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -101.27 91.33 4.46 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.43 0.633 . . . . 0.0 111.212 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -97.26 -13.47 21.97 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.395 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 26.6 m -76.9 141.03 40.71 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.361 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.5 m -51.76 -46.5 64.14 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.891 1.276 . . . . 0.0 112.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 t -112.42 20.62 16.51 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 55.91 17.76 2.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.532 1.133 . . . . 0.0 113.751 -177.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG2' HG23 ' A' ' 27' ' ' VAL . 22.1 ttmm -85.19 115.51 23.02 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.1 t -125.64 138.04 53.9 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -93.33 176.76 6.27 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.498 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 22' ' ' ARG . 19.8 ptt180 -69.81 -2.88 13.37 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.864 0.866 . . . . 0.0 112.366 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -99.33 6.19 46.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 64.39 34.77 10.16 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.957 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.627 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -132.74 144.39 50.25 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 85.5 m -64.69 131.46 46.95 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 19' ' ' LYS . 3.7 m -114.71 135.75 53.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.7 tp -89.99 127.04 55.25 Favored Pre-proline 0 C--N 1.294 -1.816 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.565 -172.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.28 164.06 33.55 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 121.88 1.72 . . . . 0.0 109.772 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -73.73 -18.76 60.95 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 121.359 0.599 . . . . 0.0 111.559 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -94.41 6.38 48.92 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 121.659 0.742 . . . . 0.0 109.531 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -111.89 168.67 12.82 Favored Glycine 0 CA--C 1.505 -0.586 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.646 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 C--N 1.304 -1.203 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.588 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 179.673 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 85.9 m . . . . . 0 C--O 1.244 0.793 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -66.15 168.77 7.97 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.862 173.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 pt . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.61 -177.031 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 . . . . . 0 CA--C 1.502 -0.881 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -89.5 155.35 19.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -83.51 141.07 31.89 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.1 p -127.61 159.9 33.24 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -132.63 170.44 15.2 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -71.14 -38.11 72.25 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 121.029 0.443 . . . . 0.0 111.364 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -96.81 1.68 50.99 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.96 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.75 88.98 2.81 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 18' ' ' ARG . 26.2 m-20 -110.86 119.9 40.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.373 -176.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -133.49 -4.26 2.96 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.513 0.673 . . . . 0.0 111.633 170.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.5 m -79.04 145.11 34.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 174.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.82 -46.16 67.61 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.649 0.738 . . . . 0.0 111.961 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -83.84 -17.26 41.55 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.611 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.431 ' HG3' ' HB3' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 59.6 22.09 10.73 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.626 0.77 . . . . 0.0 110.713 -174.504 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.69 141.81 33.05 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 113.558 0.948 . . . . 0.0 113.558 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -130.61 138.3 50.05 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 113.068 -1.878 . . . . 0.0 109.014 -178.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.467 HD22 HG13 ' A' ' 27' ' ' VAL . 9.4 p30 -98.24 -176.0 3.28 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.281 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -56.45 -28.52 59.81 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -178.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -81.49 2.0 30.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.072 0.463 . . . . 0.0 110.995 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 69.61 16.56 8.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.986 1.314 . . . . 0.0 110.634 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -97.68 159.55 14.86 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.032 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.1 t -72.34 145.04 48.05 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 124.031 0.832 . . . . 0.0 111.154 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.467 HG13 HD22 ' A' ' 21' ' ' ASN . 11.4 m -129.29 123.77 58.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 121.507 0.67 . . . . 0.0 110.326 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.97 154.91 84.85 Favored Pre-proline 0 C--N 1.308 -1.227 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.041 -174.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -70.43 164.74 34.1 Favored 'Trans proline' 0 C--O 1.249 1.059 0 C-N-CA 122.496 2.131 . . . . 0.0 110.476 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -68.29 -35.99 78.67 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 m -72.13 -39.56 68.72 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.975 0.417 . . . . 0.0 110.163 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.81 -154.8 34.44 Favored Glycine 0 C--O 1.244 0.774 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.53 29.79 0.13 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.419 -0.896 . . . . 0.0 113.729 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.782 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.802 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.438 -1.073 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -50.43 128.66 20.4 Favored 'General case' 0 C--O 1.254 1.304 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.479 ' HA ' HD23 ' A' ' 4' ' ' HYP . 34.9 pt -65.8 115.84 4.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -164.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.479 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 4.1 p-10 -159.4 11.1 0.13 Allowed 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.923 171.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -91.24 -177.28 4.83 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.816 -1.083 . . . . 0.0 108.527 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.435 ' HD2' ' HG2' ' A' ' 25' ' ' LYS . 14.5 mmmm -87.12 135.77 33.17 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.508 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 25.2 p -116.07 138.07 51.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.804 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -131.67 169.27 16.4 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -56.23 -47.02 79.31 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.448 0.468 . . . . 0.0 112.08 -177.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -102.41 12.02 37.15 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.091 0.472 . . . . 0.0 110.626 -173.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.26 99.86 9.23 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.59 101.89 11.01 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-O 121.347 0.594 . . . . 0.0 110.146 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.14 -52.8 1.04 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.462 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.0 m -70.16 115.95 9.95 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -177.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 73.4 m -59.36 -28.47 66.89 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -177.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.4 t -72.6 -35.98 68.0 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.248 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? 59.84 18.32 7.29 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.853 0.861 . . . . 0.0 111.086 -172.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -88.34 112.75 23.22 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.3 m -114.18 151.8 32.16 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 120.849 0.356 . . . . 0.0 111.054 -177.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 p30 -108.9 -176.56 3.07 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.18 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -60.37 -12.06 8.3 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 125.678 1.591 . . . . 0.0 114.119 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -104.17 7.07 36.09 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.3 m120 64.99 26.66 12.71 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.455 1.102 . . . . 0.0 110.269 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HG2' ' HD2' ' A' ' 7' ' ' LYS . 91.6 mttt -103.83 153.43 20.75 Favored 'General case' 0 N--CA 1.42 -1.953 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.15 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.5 m -79.93 145.01 32.86 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.19 164.99 23.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.5 175.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.59 131.15 84.75 Favored Pre-proline 0 C--N 1.309 -1.178 0 O-C-N 123.752 0.657 . . . . 0.0 110.597 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.88 178.68 7.12 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.489 2.126 . . . . 0.0 110.26 176.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.91 -23.38 41.85 Favored 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.5 m -64.45 -34.69 78.78 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.592 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.53 -148.61 18.71 Favored Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.601 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.2 60.82 0.6 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.001 0 C-N-CA 121.274 -0.489 . . . . 0.0 112.443 -178.655 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.6 t . . . . . 0 C--O 1.244 0.77 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.8 ttp180 -66.33 149.16 50.79 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.453 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.488 ' HA ' HD23 ' A' ' 4' ' ' HYP . 27.5 pt -39.24 124.95 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.59 0 C-N-CA 124.607 1.163 . . . . 0.0 113.9 -175.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.488 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -132.21 11.55 4.59 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 123.454 0.702 . . . . 0.0 109.293 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.677 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 15.5 mm100 -89.28 167.95 12.65 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.801 -178.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.51 148.18 22.9 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.638 174.687 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.4 p -137.83 133.52 34.05 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.245 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -137.32 177.16 8.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -71.58 -49.68 38.22 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.984 0.421 . . . . 0.0 110.493 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -88.04 -24.12 23.57 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.428 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.9 86.71 2.64 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -91.06 110.64 21.91 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.677 -176.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -112.72 -52.46 2.78 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.677 ' SG ' ' HB2' ' A' ' 6' ' ' GLN . 69.4 m -86.96 133.63 33.57 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.926 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -25.78 67.8 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.039 0.935 . . . . 0.0 112.138 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 p -78.16 -35.88 48.31 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.046 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 62.03 18.78 10.24 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.19 0.996 . . . . 0.0 110.814 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -86.33 101.39 13.05 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.6 m -108.53 145.65 34.45 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.945 -173.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 p30 -93.0 -178.07 4.69 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.562 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -67.71 -2.65 7.33 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.502 0.721 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -106.34 5.04 29.25 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 120.774 0.321 . . . . 0.0 110.222 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 65.88 24.15 11.29 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.873 0.869 . . . . 0.0 111.156 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -107.2 154.4 21.28 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.3 m -73.89 149.32 41.56 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.8 m -123.05 175.92 5.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.091 174.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.51 HD12 ' HD2' ' A' ' 29' ' ' PRO . 48.0 tp -57.71 119.87 36.89 Favored Pre-proline 0 C--N 1.323 -0.563 0 O-C-N 124.175 0.922 . . . . 0.0 111.391 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.51 ' HD2' HD12 ' A' ' 28' ' ' LEU . 63.2 Cg_endo -74.26 171.27 18.37 Favored 'Trans proline' 0 C--O 1.251 1.153 0 C-N-CA 122.721 2.281 . . . . 0.0 110.691 177.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -69.02 -15.95 63.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.078 0.466 . . . . 0.0 110.178 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.7 m 81.46 112.11 0.06 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.369 1.467 . . . . 0.0 111.941 176.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.27 67.49 0.43 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.47 -65.32 0.89 Allowed Glycine 0 C--N 1.308 -1.021 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.437 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.244 0.807 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -42.91 122.98 2.58 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 124.635 1.174 . . . . 0.0 111.943 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.5 pt -65.56 158.11 4.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.942 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.409 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.4 t30 77.4 -2.07 2.64 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.404 1.482 . . . . 0.0 111.192 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -78.91 136.15 37.19 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 172.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -82.55 141.52 32.55 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.554 -1.258 . . . . 0.0 111.032 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.0 p -125.31 149.46 48.06 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.435 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 92.9 m-85 -125.97 177.07 6.55 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 87.4 mm-40 -58.16 -41.62 84.2 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -174.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -110.0 13.12 23.47 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.223 0.535 . . . . 0.0 110.634 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 7.7 mp -120.33 102.49 8.51 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.842 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -125.98 117.61 23.64 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.697 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -132.46 22.6 4.36 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 106.457 -1.682 . . . . 0.0 106.457 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.4 m -100.45 147.16 26.17 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.482 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.5 m -81.46 -37.89 27.26 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -80.64 -24.89 38.69 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.296 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.4 mtm-85 56.04 28.29 12.6 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.07 0.948 . . . . 0.0 110.943 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -109.66 125.35 52.51 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.515 -176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.1 m -117.88 139.19 51.47 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 p30 -89.43 -174.83 4.51 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 120.834 0.349 . . . . 0.0 110.907 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.4 ptt180 -62.86 -4.87 2.37 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.363 1.465 . . . . 0.0 114.033 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.96 16.3 15.12 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.157 -0.34 . . . . 0.0 110.552 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 65.8 19.14 11.31 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.204 0.526 . . . . 0.0 111.007 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -92.07 135.31 34.07 Favored 'General case' 0 N--CA 1.428 -1.567 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 54.0 t -70.93 134.16 47.0 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.8 m -119.65 150.28 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.425 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -77.33 143.45 69.03 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.224 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.425 ' HD2' HD12 ' A' ' 28' ' ' LEU . 40.3 Cg_exo -56.36 110.33 0.56 Allowed 'Trans proline' 0 C--O 1.243 0.728 0 C-N-CA 122.33 2.02 . . . . 0.0 110.397 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -83.54 -26.47 30.09 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 -175.236 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.3 m -81.48 -21.27 38.83 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 121.455 0.645 . . . . 0.0 109.678 -177.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.63 135.21 1.87 Allowed Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.704 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 122.96 2.29 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 119.937 -1.125 . . . . 0.0 112.775 177.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.388 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 177.816 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.915 0 CA-C-O 122.54 1.162 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -103.04 123.35 46.47 Favored 'General case' 0 C--N 1.275 -2.654 0 CA-C-N 112.709 -2.042 . . . . 0.0 105.558 177.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -56.0 119.77 2.39 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 O-C-N 123.648 0.592 . . . . 0.0 111.112 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.609 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -138.6 10.37 2.69 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.59 162.34 13.34 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.504 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -84.38 132.68 34.56 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.684 0.615 . . . . 0.0 110.488 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -138.29 145.0 40.71 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-O 121.755 0.788 . . . . 0.0 110.661 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.67 -164.96 1.28 Allowed 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -72.33 -46.41 55.72 Favored 'General case' 0 N--CA 1.42 -1.931 0 CA-C-O 120.754 0.311 . . . . 0.0 111.157 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -105.28 -7.22 19.06 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 120.976 0.417 . . . . 0.0 112.098 -176.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mp -114.89 93.81 4.48 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -153.89 138.3 16.73 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -133.76 -0.15 3.18 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.812 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -70.11 131.59 44.52 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.219 -0.301 . . . . 0.0 110.533 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.8 m -58.63 -32.2 68.82 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.462 0.649 . . . . 0.0 110.032 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.25 -36.21 79.38 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.76 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.17 26.51 10.37 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.598 1.159 . . . . 0.0 111.745 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 59.1 tttp -126.34 132.19 51.64 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.1 m -119.96 142.8 48.43 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.203 0.314 . . . . 0.0 110.545 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -90.38 -179.19 5.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -58.47 -29.33 66.12 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -88.53 13.59 11.7 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.706 0.288 . . . . 0.0 111.292 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 m120 64.86 29.81 12.37 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -109.43 147.94 31.99 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.652 -0.819 . . . . 0.0 109.112 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.609 ' HB2' ' HA ' ' A' ' 4' ' ' HYP . 59.7 m -62.7 142.59 58.05 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 124.07 0.856 . . . . 0.0 110.848 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.9 168.78 21.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -88.77 122.93 68.8 Favored Pre-proline 0 C--N 1.312 -1.037 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -81.65 -166.64 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.52 2.814 . . . . 0.0 110.236 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 mp0 -76.31 -33.19 59.04 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.9 p -77.75 -16.76 58.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.273 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.11 -147.16 23.4 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.335 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 115.89 54.1 0.36 Allowed Glycine 0 C--N 1.301 -1.389 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 C-N-CA 121.578 -0.344 . . . . 0.0 113.566 -176.391 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -57.79 141.34 49.21 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pp -82.22 152.65 4.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.879 -176.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.553 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 t30 82.87 -24.68 0.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.616 1.566 . . . . 0.0 112.372 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.96 145.02 52.03 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -77.45 139.46 39.66 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 p -119.95 133.81 55.44 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -125.33 143.03 51.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 121.254 0.549 . . . . 0.0 111.869 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.434 ' HG3' ' ND1' ' A' ' 11' ' ' HIS . 11.8 pt20 -61.85 -16.18 48.12 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.317 1.047 . . . . 0.0 113.797 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.434 ' ND1' ' HG3' ' A' ' 10' ' ' GLN . 76.1 m80 -112.5 13.72 20.16 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.023 -0.423 . . . . 0.0 111.938 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -121.82 165.19 16.25 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -115.0 30.66 7.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.649 0.738 . . . . 0.0 109.194 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -48.44 -52.53 21.69 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.019 1.328 . . . . 0.0 112.858 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 74.7 m -108.63 152.36 24.9 Favored 'General case' 0 C--N 1.278 -2.514 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.146 176.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -59.55 -45.63 91.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 t -108.37 -15.72 14.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.831 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 82.8 mtm180 49.35 51.01 17.13 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.505 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.45 100.82 4.61 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.7 m -96.55 130.43 43.73 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.02 -173.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.448 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.8 p30 -80.27 -175.87 5.32 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.465 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -67.51 -2.95 7.32 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -115.52 12.65 16.23 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.3 m120 63.66 23.57 13.58 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.944 0.878 . . . . 0.0 110.93 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' HD21 ' A' ' 21' ' ' ASN . 98.4 mttt -96.91 146.12 25.25 Favored 'General case' 0 N--CA 1.411 -2.375 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.129 174.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.553 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 27.3 t -84.71 143.52 29.13 Favored 'General case' 0 C--N 1.256 -3.488 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.448 -174.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 m -125.25 136.48 60.71 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.075 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -55.9 147.33 43.83 Favored Pre-proline 0 C--O 1.244 0.777 0 O-C-N 123.656 0.598 . . . . 0.0 112.169 -174.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.87 136.63 43.54 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.257 2.638 . . . . 0.0 111.349 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -70.25 -9.89 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 p -77.47 -30.3 53.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 121.326 0.584 . . . . 0.0 110.017 172.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.67 168.15 31.04 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.575 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.57 173.86 13.18 Favored Glycine 0 N--CA 1.427 -1.915 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.147 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.108 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 178.401 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.564 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 tpp180 -67.03 127.93 34.45 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 173.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 pt -59.35 149.22 6.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 O-C-N 123.951 0.782 . . . . 0.0 111.659 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.582 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 80.01 -9.28 1.43 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.813 1.245 . . . . 0.0 112.552 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -79.63 151.88 30.32 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mmmp? -74.46 130.55 39.83 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.069 0.461 . . . . 0.0 112.098 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.452 ' HA ' HD23 ' A' ' 12' ' ' LEU . 26.4 p -114.54 159.04 20.85 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 175.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -146.0 163.48 35.06 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 -177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -75.44 -15.74 60.4 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.162 0.506 . . . . 0.0 112.216 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -101.56 12.13 37.78 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.691 0.757 . . . . 0.0 110.091 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 8' ' ' CYS . 33.9 tp -120.03 149.61 41.88 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.23 19.44 2.77 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.509 -1.276 . . . . 0.0 112.369 -174.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.564 ' HB3' ' HB2' ' A' ' 2' ' ' ARG . 7.9 m-20 -67.71 -17.07 64.44 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.0 m -85.76 110.36 19.29 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.5 m -53.33 -44.78 68.73 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.6 t -102.56 9.88 39.16 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.475 0.655 . . . . 0.0 110.139 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' ARG . 4.5 mpt_? 59.08 31.25 21.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.104 0.962 . . . . 0.0 111.63 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.45 120.14 25.09 Favored 'General case' 0 CA--C 1.501 -0.927 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.254 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.5 m -131.02 148.93 52.81 Favored 'General case' 0 C--N 1.275 -2.67 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.594 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -88.41 176.92 6.98 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -66.39 -15.14 63.07 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -95.89 6.19 49.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 120.734 0.302 . . . . 0.0 111.122 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 71.69 32.66 1.93 Allowed 'General case' 0 C--O 1.26 1.619 0 C-N-CA 123.877 0.871 . . . . 0.0 112.185 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.82 149.25 25.22 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 172.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.582 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 21.2 t -78.93 135.15 36.88 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -176.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 m -118.21 145.28 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 CA-C-O 120.958 0.408 . . . . 0.0 110.436 177.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.474 HD12 ' HD2' ' A' ' 29' ' ' PRO . 29.2 tp -67.82 127.28 93.35 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.921 -171.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.474 ' HD2' HD12 ' A' ' 28' ' ' LEU . 78.3 Cg_endo -82.83 175.87 8.24 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.773 2.315 . . . . 0.0 111.42 175.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -92.12 -48.26 6.81 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.154 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.7 m -59.94 -48.32 82.17 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -115.52 149.59 18.82 Favored Glycine 0 N--CA 1.434 -1.44 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.549 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.24 -27.78 5.18 Favored Glycine 0 C--N 1.306 -1.092 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.774 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 CA-C-O 121.505 0.503 . . . . 0.0 111.986 -178.018 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 122.309 1.052 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.491 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 17.6 tpp180 -100.01 139.19 36.04 Favored 'General case' 0 C--N 1.273 -2.755 0 CA-C-N 113.823 -1.535 . . . . 0.0 106.914 168.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.8 pt -63.29 147.88 11.77 Favored 'Isoleucine or valine' 0 C--O 1.246 0.909 0 O-C-N 123.267 0.354 . . . . 0.0 110.701 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 76.27 -5.32 2.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.004 1.322 . . . . 0.0 112.527 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -84.06 158.38 21.46 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -80.74 126.08 30.86 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 120.736 0.303 . . . . 0.0 110.46 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 p -131.12 138.59 49.58 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -129.95 175.77 8.6 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -64.16 -19.93 65.65 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -118.22 13.47 13.74 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.399 0.619 . . . . 0.0 110.045 175.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -135.21 35.07 3.03 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.467 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 11.1 m-20 -79.44 87.59 5.06 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.802 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -87.78 -12.71 44.29 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.797 0.808 . . . . 0.0 109.814 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.491 ' SG ' ' HB3' ' A' ' 2' ' ' ARG . 29.7 m -81.16 118.22 22.37 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 173.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.6 m -63.86 -32.84 74.49 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -169.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -81.86 -7.94 59.64 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.592 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.467 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 77.6 mtp180 57.52 28.54 15.7 Favored 'General case' 0 C--N 1.358 0.936 0 C-N-CA 124.877 1.271 . . . . 0.0 111.413 -176.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.6 tttm -83.16 100.53 10.61 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -128.1 144.79 51.13 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.651 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -89.39 -179.1 5.76 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 120.964 0.412 . . . . 0.0 111.301 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -63.47 -18.07 63.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -93.58 5.24 52.27 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.134 0.492 . . . . 0.0 109.717 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 68.52 24.39 7.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.306 1.043 . . . . 0.0 110.882 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -97.11 135.83 38.52 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.3 t -68.05 135.98 53.1 Favored 'General case' 0 C--N 1.287 -2.145 0 O-C-N 123.559 0.537 . . . . 0.0 109.653 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.2 m -117.62 143.03 29.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 CA-C-O 120.601 0.239 . . . . 0.0 110.544 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.414 HD12 ' HD2' ' A' ' 29' ' ' PRO . 35.4 tp -67.48 125.51 91.27 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.845 -172.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.414 ' HD2' HD12 ' A' ' 28' ' ' LEU . 6.7 Cg_exo -69.11 107.87 1.83 Allowed 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.672 2.248 . . . . 0.0 108.72 170.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -15.62 62.2 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.252 0.549 . . . . 0.0 112.056 -174.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -112.51 9.52 19.56 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.037 0.922 . . . . 0.0 108.936 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -145.23 -133.54 2.61 Favored Glycine 0 N--CA 1.435 -1.37 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -157.89 152.14 23.34 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.489 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.034 -178.132 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' HG ' ' A' ' 28' ' ' LEU . 33.6 m . . . . . 0 N--CA 1.443 -0.812 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.4 HH21 ' CG ' ' A' ' 14' ' ' ASP . 4.1 tpp180 -62.11 136.28 57.88 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 173.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 pt -49.59 135.37 7.65 Favored 'Isoleucine or valine' 0 C--O 1.254 1.342 0 O-C-N 123.753 0.658 . . . . 0.0 111.941 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.598 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -136.8 -22.97 1.21 Allowed 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.979 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -76.09 164.65 25.91 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 27.6 mtpp -78.38 171.23 15.39 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.137 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -117.83 133.46 55.91 Favored 'General case' 0 C--N 1.285 -2.225 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -125.53 160.55 29.26 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -62.14 -25.57 67.82 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 123.489 0.716 . . . . 0.0 112.462 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -101.92 6.23 41.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.702 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.7 tp -97.65 95.16 7.4 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.236 0.541 . . . . 0.0 110.175 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -97.02 10.89 37.98 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.539 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' CG ' HH21 ' A' ' 2' ' ' ARG . 14.1 t70 -78.41 -23.79 46.55 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.448 1.118 . . . . 0.0 108.443 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.1 m -79.88 107.49 12.7 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 170.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.3 m -52.31 -47.09 66.14 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.716 0.635 . . . . 0.0 112.665 -169.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.7 m -98.85 4.83 47.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.771 -177.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 53.37 30.78 10.82 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.449 0.7 . . . . 0.0 110.358 -175.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -83.26 130.72 35.09 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.112 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 63.7 m -120.17 151.68 38.76 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.217 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' LYS . 39.5 p30 -99.89 -176.16 3.17 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 174.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -62.61 -11.92 19.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.9 12.03 29.29 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 121.888 -0.507 . . . . 0.0 110.745 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 66.28 25.13 10.56 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 122.136 0.969 . . . . 0.0 108.95 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 68.3 mttm -93.81 160.4 14.76 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.572 176.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.598 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 52.2 t -84.67 143.93 28.9 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.0 m -140.22 154.2 22.77 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 CA-C-O 120.97 0.414 . . . . 0.0 110.036 175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.436 ' HG ' ' HB2' ' A' ' 1' ' ' CYS . 7.8 mp -90.29 154.73 46.85 Favored Pre-proline 0 C--N 1.305 -1.365 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.06 179.95 5.26 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 122.291 1.994 . . . . 0.0 111.01 174.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.56 -32.16 73.08 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 122.79 0.436 . . . . 0.0 111.412 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.9 p -83.58 2.73 35.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.59 -113.29 4.17 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.366 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.14 170.9 29.69 Favored Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.304 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 179.335 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.955 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -46.87 123.59 5.34 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.552 1.141 . . . . 0.0 110.612 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.431 ' HA ' HD23 ' A' ' 4' ' ' HYP . 33.6 pt -58.25 151.43 4.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -174.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.431 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -108.55 1.65 21.59 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.238 1.018 . . . . 0.0 109.397 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -83.83 168.34 16.22 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.309 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -86.83 132.37 33.85 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.663 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 27.7 p -115.0 141.55 47.84 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -148.08 157.26 43.41 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.57 -35.64 80.14 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.187 0.518 . . . . 0.0 111.241 -176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.0 p-80 -95.89 11.28 34.37 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.882 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.8 tp -114.4 111.97 22.28 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 121.663 0.744 . . . . 0.0 109.086 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -94.86 15.72 17.84 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.704 -174.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -60.79 -48.79 80.22 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.721 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.0 m -90.24 127.4 36.13 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.78 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.4 m -50.55 -42.2 55.08 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 125.832 1.653 . . . . 0.0 112.687 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 29' ' ' PRO . 29.9 p -83.66 -23.13 31.91 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? 61.61 16.39 7.66 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.18 0.592 . . . . 0.0 110.86 -172.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 13.7 mmmm -90.74 150.71 21.51 Favored 'General case' 0 CA--C 1.48 -1.73 0 O-C-N 122.086 -0.384 . . . . 0.0 110.98 -177.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.4 m -127.09 142.57 51.49 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-N 114.556 -1.202 . . . . 0.0 112.277 -173.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.453 HD21 ' HB2' ' A' ' 25' ' ' LYS . 33.5 p30 -104.31 -177.66 3.43 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.324 174.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -62.64 -15.22 50.93 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -100.18 5.59 44.77 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 121.998 -0.439 . . . . 0.0 111.487 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 t30 71.64 17.04 5.66 Favored 'General case' 0 N--CA 1.505 2.317 0 CA-C-O 123.394 1.568 . . . . 0.0 108.9 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.9 mttm -94.53 158.32 15.59 Favored 'General case' 0 N--CA 1.415 -2.213 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.297 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.663 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.0 m -74.51 150.88 39.62 Favored 'General case' 0 C--N 1.281 -2.407 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.123 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' LYS . 3.0 m -130.57 116.96 37.26 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.348 0.594 . . . . 0.0 109.477 170.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 24.6 tp -90.29 142.68 28.61 Favored Pre-proline 0 C--N 1.289 -2.031 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 17' ' ' SER . 85.0 Cg_exo -51.77 154.61 9.3 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 123.099 2.532 . . . . 0.0 113.028 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.46 -22.93 35.0 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.4 p -77.85 87.89 4.06 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 123.95 -97.25 0.55 Allowed Glycine 0 N--CA 1.423 -2.223 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.99 -13.83 63.62 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 121.212 -0.518 . . . . 0.0 113.602 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.18 0 C-N-CA 121.37 -0.443 . . . . 0.0 112.747 -176.767 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.435 -1.222 0 CA-C-O 121.224 0.535 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -69.68 135.39 49.8 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.507 HG13 ' HG2' ' A' ' 6' ' ' GLN . 30.0 pt -53.89 138.18 13.8 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -176.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -87.88 7.88 28.69 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -175.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.507 ' HG2' HG13 ' A' ' 3' ' ' ILE . 84.3 mm-40 -83.4 152.07 25.2 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 120.647 0.261 . . . . 0.0 110.418 177.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.42 122.51 27.59 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.392 178.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 26' ' ' CYS . 25.3 p -129.15 155.75 45.0 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -122.37 -174.31 2.88 Favored 'General case' 0 C--N 1.293 -1.863 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.298 -176.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -69.41 -40.02 77.58 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -175.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -105.38 -21.55 13.21 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.302 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 mp -114.09 103.6 11.29 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.068 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' OD1' ' HA ' ' A' ' 18' ' ' ARG . 1.6 p30 -148.93 163.0 38.74 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -133.1 31.44 3.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.2 m -95.92 139.06 32.67 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.883 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 m -60.3 -37.97 82.19 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 121.549 0.69 . . . . 0.0 110.651 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -85.97 -10.32 55.33 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.72 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.466 ' HA ' ' OD1' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 62.07 17.86 9.47 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.583 1.153 . . . . 0.0 110.949 -174.733 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -105.18 140.94 37.58 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 121.774 0.797 . . . . 0.0 112.233 -173.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.7 m -131.2 147.87 52.64 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -84.52 -175.27 5.71 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 118.476 0.58 . . . . 0.0 110.001 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -68.63 -8.23 40.26 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -103.46 7.16 37.93 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m120 63.58 32.15 14.21 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 124.024 0.929 . . . . 0.0 112.295 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -92.33 138.48 31.48 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 174.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.459 ' HA ' ' SG ' ' A' ' 8' ' ' CYS . 42.5 t -62.76 113.98 3.35 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 124.024 0.827 . . . . 0.0 110.712 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . 0.255 24.8 m -105.24 102.69 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 CA-C-O 122.842 1.306 . . . . 0.0 112.374 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.21 155.77 91.51 Favored Pre-proline 0 C--N 1.3 -1.55 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.674 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -75.47 174.09 13.39 Favored 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 120.876 1.051 . . . . 0.0 109.938 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -66.93 -29.91 69.91 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.672 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -63.72 -25.09 68.04 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.062 176.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.37 -137.21 34.96 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 128.99 -164.94 21.94 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.239 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 177.4 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.3 ttm-85 -51.6 124.65 12.71 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 119.457 1.026 . . . . 0.0 112.144 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt -65.33 155.52 6.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.0 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 83.65 -15.18 0.64 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 126.483 1.913 . . . . 0.0 111.737 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -69.55 153.78 42.97 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -77.92 159.31 28.95 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.492 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 18.0 p -123.26 150.98 42.82 Favored 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 112.943 -1.935 . . . . 0.0 106.009 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.4 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 90.1 m-85 -126.48 174.05 8.93 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -59.02 -44.88 91.77 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 123.833 0.708 . . . . 0.0 111.463 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -118.43 -30.68 5.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.808 175.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 6.9 mp -77.78 92.37 4.19 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.873 0.844 . . . . 0.0 111.521 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -127.42 118.2 23.62 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.082 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -123.79 12.98 9.21 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 122.861 1.315 . . . . 0.0 107.931 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m -83.86 111.1 18.91 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 m -57.38 -26.14 60.59 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 123.477 0.711 . . . . 0.0 111.786 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 p -71.45 -27.87 63.56 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.427 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 54.8 21.84 3.83 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 125.077 1.351 . . . . 0.0 113.361 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -119.88 125.22 47.97 Favored 'General case' 0 N--CA 1.415 -2.205 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.407 ' SG ' ' HA ' ' A' ' 24' ' ' ASN . 42.6 t -130.67 142.9 50.44 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.9 p30 -90.01 178.2 6.26 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 120.975 0.417 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -64.26 -18.67 64.78 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -88.62 0.97 55.84 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.675 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.407 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 4.6 m-20 73.74 27.67 1.7 Allowed 'General case' 0 C--O 1.246 0.894 0 C-N-CA 124.15 0.98 . . . . 0.0 111.454 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -106.6 129.72 54.48 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 71.1 m -70.38 135.35 48.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.7 m -123.02 150.98 27.09 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.357 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.0 tp -90.01 141.32 27.9 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 -176.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.55 175.64 8.47 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 121.775 1.65 . . . . 0.0 112.627 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -28.93 70.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.476 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -78.28 -3.08 41.1 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.855 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.33 -145.68 29.58 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.795 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 146.55 140.26 3.43 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.538 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.437 -1.125 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -61.46 130.89 48.2 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 117.71 0.232 . . . . 0.0 110.384 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.49 HD13 ' H ' ' A' ' 3' ' ' ILE . 0.2 OUTLIER -53.8 140.67 10.04 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 O-C-N 124.043 0.839 . . . . 0.0 113.096 -178.35 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -127.05 9.45 6.82 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.436 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.3 mm-40 -99.09 175.59 5.85 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.985 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 150.17 21.81 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.281 -178.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.2 p -147.16 161.22 41.34 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.488 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 91.8 m-85 -134.06 -170.86 2.6 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -70.04 -49.4 51.66 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -103.11 -4.04 25.04 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.923 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 79.9 mt -99.92 94.03 6.08 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.408 ' HB3' ' HG2' ' A' ' 18' ' ' ARG . 11.5 m-20 -95.36 80.14 3.5 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.515 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.57 -49.21 56.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.68 0.753 . . . . 0.0 109.171 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -80.06 141.94 35.38 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.125 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.19 -21.84 62.1 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 124.183 0.993 . . . . 0.0 110.513 -175.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.7 p -70.24 -28.08 64.97 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.308 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HG2' ' HB3' ' A' ' 13' ' ' ASP . 76.7 mtp180 57.0 26.88 12.43 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.489 1.116 . . . . 0.0 111.49 -177.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -121.08 120.58 35.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.039 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.4 m -109.69 151.43 26.9 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.16 -178.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -103.16 -173.75 2.39 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -68.22 -11.33 59.12 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -94.06 1.67 56.15 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 68.13 22.44 8.31 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 122.403 1.097 . . . . 0.0 110.368 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -106.7 163.74 12.66 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.282 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.7 m -79.86 148.57 31.28 Favored 'General case' 0 C--N 1.284 -2.264 0 O-C-N 123.433 0.458 . . . . 0.0 110.779 -177.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.1 m -126.4 170.52 16.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.324 173.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.87 131.29 70.65 Favored Pre-proline 0 N--CA 1.434 -1.266 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.53 159.67 28.73 Favored 'Trans proline' 0 N--CA 1.444 -1.416 0 C-N-CA 122.154 1.903 . . . . 0.0 110.784 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.87 -16.98 62.15 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.738 0.78 . . . . 0.0 110.066 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.6 p -81.22 -0.32 40.07 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.81 -90.49 1.66 Allowed Glycine 0 N--CA 1.431 -1.667 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 88.73 -174.91 43.29 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.485 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.575 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.853 0.835 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.18 140.35 30.23 Favored 'General case' 0 C--N 1.264 -3.123 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.559 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.467 ' HA ' HD23 ' A' ' 4' ' ' HYP . 12.8 pt -72.53 133.07 32.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.467 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.96 0.19 10.74 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.48 141.97 51.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.75 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.517 ' N ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -67.86 145.66 54.41 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 167.661 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -115.94 145.29 43.05 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 117.443 -1.703 . . . . 0.0 113.382 -176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -137.39 133.36 34.7 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -55.26 -33.7 63.4 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -99.96 5.89 45.19 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.6 mt -91.34 139.73 30.45 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.533 -0.867 . . . . 0.0 111.444 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -82.71 -8.6 59.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.723 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -52.17 -39.44 60.06 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.329 1.052 . . . . 0.0 109.484 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 59.1 m -92.65 99.54 12.22 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.402 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.3 m -58.4 -37.4 75.24 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.49 0.662 . . . . 0.0 109.916 176.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 m -75.92 -23.72 55.49 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.8 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 53.14 23.23 2.95 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.292 1.037 . . . . 0.0 113.371 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.43 140.44 49.14 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -128.23 151.97 48.64 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.869 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -94.94 174.95 6.84 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -64.03 -12.25 36.76 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -99.86 9.95 42.14 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 122.439 -0.163 . . . . 0.0 111.288 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 t30 72.3 17.22 4.93 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 124.403 1.081 . . . . 0.0 111.269 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -93.38 146.88 23.41 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.1 t -87.97 112.52 22.66 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.3 m -102.2 162.96 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 121.392 0.615 . . . . 0.0 112.29 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.03 139.32 79.58 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.56 156.32 42.72 Favored 'Trans proline' 0 C--O 1.24 0.577 0 C-N-CA 122.304 2.003 . . . . 0.0 110.539 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.09 -20.7 62.32 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.702 0.287 . . . . 0.0 111.385 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -88.4 -9.44 52.61 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.924 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 116.61 -143.4 18.04 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.815 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.42 -148.85 19.2 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.453 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.49 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.291 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' HD3' ' A' ' 29' ' ' PRO . 18.3 t . . . . . 0 C--O 1.247 0.957 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -59.52 178.43 0.15 Allowed 'General case' 0 C--O 1.251 1.16 0 CA-C-O 122.312 1.053 . . . . 0.0 111.566 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.462 HG13 ' HG2' ' A' ' 6' ' ' GLN . 15.6 pt -76.2 133.02 31.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.454 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -125.86 3.9 7.36 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 174.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.462 ' HG2' HG13 ' A' ' 3' ' ' ILE . 15.8 mm100 -64.42 142.18 58.51 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -93.03 124.14 36.79 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.28 151.08 52.0 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -128.75 -165.38 1.5 Allowed 'General case' 0 C--N 1.285 -2.202 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -73.74 -49.74 24.08 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.615 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -90.68 -29.91 17.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.251 0.548 . . . . 0.0 110.345 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.27 82.43 5.46 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.49 ' CG ' ' HG2' ' A' ' 18' ' ' ARG . 13.2 t70 -105.79 137.13 44.19 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.57 -178.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -128.91 -0.35 5.32 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.488 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 64.0 m -95.48 177.23 5.89 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.472 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -80.38 -33.38 37.21 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.819 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 m -134.89 24.46 3.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.607 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HG2' ' CG ' ' A' ' 13' ' ' ASP . 58.9 mtm180 50.12 24.57 1.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 124.07 0.948 . . . . 0.0 112.808 -175.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -85.2 107.58 17.32 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.914 0.864 . . . . 0.0 111.821 -177.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 m -117.92 136.48 53.45 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.574 -1.648 . . . . 0.0 108.819 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -81.05 -177.73 6.57 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 120.757 0.313 . . . . 0.0 110.947 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.46 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -56.31 -21.0 21.38 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -101.39 7.61 42.57 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.913 -0.492 . . . . 0.0 110.456 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.0 m120 66.23 25.67 10.55 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 123.943 0.897 . . . . 0.0 112.786 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -90.38 142.3 27.87 Favored 'General case' 0 N--CA 1.422 -1.828 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.556 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 18.4 t -67.07 125.46 26.07 Favored 'General case' 0 C--N 1.286 -2.155 0 O-C-N 124.654 1.221 . . . . 0.0 109.317 178.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.9 m -115.03 176.08 2.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-O 120.997 0.427 . . . . 0.0 111.008 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.61 148.7 87.95 Favored Pre-proline 0 C--N 1.303 -1.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.029 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 1' ' ' CYS . 61.0 Cg_endo -74.42 172.26 16.47 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.656 2.238 . . . . 0.0 112.241 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -103.81 -26.04 12.86 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.646 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 m -85.18 -48.21 9.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.483 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -93.74 -178.41 39.41 Favored Glycine 0 C--O 1.244 0.725 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.915 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.62 -69.59 0.98 Allowed Glycine 0 C--O 1.243 0.688 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.511 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.258 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -58.97 160.98 5.37 Favored 'General case' 0 C--O 1.249 1.028 0 C-N-CA 123.061 0.544 . . . . 0.0 111.069 175.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 pt -77.45 149.43 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.654 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -116.37 -0.86 12.43 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.738 -0.601 . . . . 0.0 111.995 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -79.06 147.45 32.8 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.812 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.462 ' O ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -88.9 149.11 23.49 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 176.617 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.3 p -145.1 141.5 28.87 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -119.46 172.05 7.91 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -54.23 -41.51 68.8 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -105.78 3.58 28.97 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.446 0.641 . . . . 0.0 110.798 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.4 mt -124.11 75.01 1.34 Allowed 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.082 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.407 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 8.2 m-20 -100.24 113.84 26.83 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.008 -178.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -113.1 -10.37 13.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.584 0.706 . . . . 0.0 110.161 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.4 m -71.9 139.46 48.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -54.18 -46.21 72.31 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.951 0.9 . . . . 0.0 111.711 -175.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t -101.33 13.69 34.3 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.407 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 83.3 mtp180 51.65 30.89 7.13 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.345 1.058 . . . . 0.0 112.023 -176.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -94.01 113.71 25.75 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.5 -172.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -125.11 136.55 53.75 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -85.37 -171.75 3.78 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.989 0.423 . . . . 0.0 111.788 -178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -66.83 -10.1 44.45 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.466 0.706 . . . . 0.0 112.785 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -108.15 11.03 27.84 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.48 25.18 15.0 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.536 0.735 . . . . 0.0 111.445 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -94.71 145.69 24.68 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 12.2 t -71.5 135.79 47.28 Favored 'General case' 0 C--N 1.283 -2.29 0 O-C-N 124.572 1.17 . . . . 0.0 108.417 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.1 m -129.72 137.06 57.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 121.385 0.612 . . . . 0.0 111.523 178.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.457 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -73.07 128.11 88.32 Favored Pre-proline 0 C--N 1.305 -1.368 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 176.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 28' ' ' LEU . 18.8 Cg_endo -58.87 161.23 15.87 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.562 2.175 . . . . 0.0 111.823 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.42 -9.22 55.81 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.859 -175.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.3 p -69.78 -29.23 66.51 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.241 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.18 -151.69 20.86 Favored Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.544 -1.023 . . . . 0.0 110.544 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.5 30.54 Favored Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.889 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.986 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.375 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.516 ' SG ' ' HA ' ' A' ' 31' ' ' THR . 63.1 m . . . . . 0 N--CA 1.437 -1.121 0 CA-C-O 120.645 0.259 . . . . 0.0 110.77 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -64.19 152.31 41.08 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.902 0.881 . . . . 0.0 110.933 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.5 pt -65.9 152.36 9.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.381 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 73.41 9.65 5.08 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.928 0.891 . . . . 0.0 111.7 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -72.93 158.58 35.21 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.819 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -90.0 113.95 25.71 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.93 146.74 52.06 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-O 121.673 0.749 . . . . 0.0 110.558 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.08 -173.53 2.92 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -66.51 -49.77 65.43 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.283 0.564 . . . . 0.0 110.285 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -85.36 -27.17 26.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 110.315 -178.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.2 mp -98.67 79.03 2.4 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.005 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 8.7 p-10 -93.47 126.38 38.59 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -117.77 3.27 12.28 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.403 -176.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.1 m -130.83 149.75 52.32 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 121.792 -0.567 . . . . 0.0 110.862 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -51.79 -46.49 64.21 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.145 0.978 . . . . 0.0 112.4 -178.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -84.42 -3.55 58.4 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.986 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.44 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 74.6 mtt180 51.32 29.08 4.74 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.261 1.025 . . . . 0.0 112.416 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HE2' HG23 ' A' ' 27' ' ' VAL . 19.4 ptmt -94.77 126.54 40.15 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-O 122.205 1.002 . . . . 0.0 110.907 -176.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -127.96 141.79 51.43 Favored 'General case' 0 C--N 1.257 -3.433 0 CA-C-N 113.68 -1.6 . . . . 0.0 108.237 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -82.51 -176.51 6.27 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -65.95 -11.24 46.03 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.12 4.09 31.02 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 122.31 -0.244 . . . . 0.0 110.941 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m120 76.26 22.3 1.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.683 0.793 . . . . 0.0 112.495 -178.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -96.79 131.37 43.58 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.4 t -62.71 131.19 48.11 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.707 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.456 HG23 ' HE2' ' A' ' 19' ' ' LYS . 1.8 m -102.34 167.13 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.69 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.311 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 28' ' ' LEU . 5.1 mp -58.52 114.28 8.48 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -169.067 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.91 162.89 38.27 Favored 'Trans proline' 0 C--O 1.243 0.77 0 C-N-CA 123.351 2.701 . . . . 0.0 112.541 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.25 -30.98 71.49 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.86 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.516 ' HA ' ' SG ' ' A' ' 1' ' ' CYS . 31.1 m 74.96 107.31 0.07 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.199 1.399 . . . . 0.0 112.599 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.12 66.06 0.42 Allowed Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.11 -69.51 3.28 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.177 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 178.623 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.441 -0.913 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.96 133.4 56.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 118.156 0.434 . . . . 0.0 109.98 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.501 ' HA ' HD23 ' A' ' 4' ' ' HYP . 32.4 pt -45.9 134.97 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -173.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.501 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -137.66 13.41 2.95 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 122.419 1.104 . . . . 0.0 109.328 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -90.03 140.8 29.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -72.0 141.42 49.36 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 123.282 0.364 . . . . 0.0 111.409 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.5 p -118.92 163.87 16.29 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.526 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 50.0 m-85 -134.96 158.58 43.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.48 -26.83 68.74 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.554 0.692 . . . . 0.0 110.246 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -110.86 16.17 21.43 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.334 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.526 ' HB3' ' HB2' ' A' ' 9' ' ' PHE . 37.6 tp -142.27 104.84 4.5 Favored 'General case' 0 N--CA 1.426 -1.632 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.727 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -109.07 117.26 33.72 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.625 0.726 . . . . 0.0 110.153 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -132.68 27.96 4.3 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.66 163.65 13.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.885 -1.507 . . . . 0.0 111.998 -173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.5 m -83.99 -46.26 12.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.617 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 m -96.47 -3.96 42.45 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.761 -174.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 54.87 21.34 3.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -107.2 141.77 37.96 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.067 -175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.87 152.09 28.35 Favored 'General case' 0 C--N 1.283 -2.32 0 CA-C-N 114.893 -1.049 . . . . 0.0 108.847 176.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.41 -179.63 4.98 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 174.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -67.59 -7.25 24.79 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 123.026 0.53 . . . . 0.0 112.226 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -102.71 5.17 38.81 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.18 -179.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.3 t30 70.5 20.12 6.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 123.21 1.481 . . . . 0.0 110.622 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -100.02 153.24 19.36 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.612 -1.177 . . . . 0.0 108.133 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.78 129.08 36.23 Favored 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.462 ' HA ' ' HB2' ' A' ' 4' ' ' HYP . 22.6 m -130.83 149.99 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.656 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.5 tp -88.8 124.25 65.88 Favored Pre-proline 0 C--N 1.306 -1.307 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 172.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -74.71 -171.55 0.98 Allowed 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 122.029 1.819 . . . . 0.0 111.638 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -66.05 -23.98 66.64 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.246 0.546 . . . . 0.0 110.925 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.3 p -84.69 102.55 13.06 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 145.5 147.68 4.66 Favored Glycine 0 N--CA 1.431 -1.697 0 N-CA-C 110.214 -1.154 . . . . 0.0 110.214 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.89 -38.27 6.54 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.938 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.787 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.521 ' HD2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.73 166.46 13.05 Favored 'General case' 0 C--O 1.249 1.029 0 C-N-CA 120.824 -0.351 . . . . 0.0 110.435 173.849 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.8 pt -69.71 156.86 6.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.574 -178.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -87.7 1.09 54.7 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 121.822 -0.549 . . . . 0.0 111.298 -178.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.517 ' HG3' ' HB3' ' A' ' 2' ' ' ARG . 16.1 mm100 -75.95 152.97 36.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.053 0.454 . . . . 0.0 110.876 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -94.92 116.81 29.18 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.7 p -118.45 160.99 20.74 Favored 'General case' 0 C--N 1.275 -2.653 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.01 -176.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -134.52 155.47 50.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -63.77 -27.7 69.37 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.396 0.617 . . . . 0.0 111.764 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -98.31 16.25 22.08 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.649 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 47.2 tp -136.45 108.25 7.07 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-O 120.917 0.389 . . . . 0.0 110.092 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -82.61 73.89 9.62 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.676 1.227 . . . . 0.0 111.512 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.521 ' O ' ' HD2' ' A' ' 2' ' ' ARG . 33.8 t70 -95.39 -29.07 14.63 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 174.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.1 m -109.92 135.47 50.73 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.9 m -50.45 -47.41 56.85 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -94.32 2.58 55.83 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.882 -173.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 55.0 30.32 13.94 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.556 0.693 . . . . 0.0 110.974 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -84.92 116.12 23.17 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.457 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 24' ' ' ASN . 63.4 m -129.36 145.61 51.37 Favored 'General case' 0 C--N 1.277 -2.562 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.167 -177.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.402 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.2 p30 -83.51 -174.48 5.31 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -63.01 -16.42 59.75 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -102.61 12.17 36.75 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 20' ' ' CYS 0.306 3.3 p-10 50.46 36.91 14.4 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.894 1.678 . . . . 0.0 112.066 -175.673 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.8 mttm -91.3 153.97 19.57 Favored 'General case' 0 N--CA 1.424 -1.754 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.4 t -71.86 130.97 42.34 Favored 'General case' 0 C--N 1.286 -2.175 0 O-C-N 123.855 0.722 . . . . 0.0 112.01 -172.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.4 m -124.5 113.98 38.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.812 0.815 . . . . 0.0 110.262 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.4 tp -71.26 129.88 88.53 Favored Pre-proline 0 C--N 1.31 -1.139 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.352 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.478 ' HD2' HD12 ' A' ' 28' ' ' LEU . 10.5 Cg_endo -53.46 110.08 0.44 Allowed 'Trans proline' 0 C--N 1.367 1.512 0 C-N-CA 123.38 2.72 . . . . 0.0 112.218 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 60.2 18.22 7.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.73 1.212 . . . . 0.0 112.289 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 m 58.37 38.39 25.81 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-O 122.124 0.964 . . . . 0.0 109.542 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -151.06 94.85 0.15 Allowed Glycine 0 N--CA 1.435 -1.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.76 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.3 154.17 19.68 Favored Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.38 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 178.405 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.85 149.2 44.9 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.417 ' HA ' HD23 ' A' ' 4' ' ' HYP . 43.4 pt -66.47 148.47 12.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.936 -177.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.417 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.7 m-20 -140.02 7.73 2.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.958 1.303 . . . . 0.0 109.732 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -81.84 150.97 27.56 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -89.96 167.51 12.74 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.588 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.9 p -154.21 147.77 25.17 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.203 -176.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -135.29 175.63 9.41 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.1 -43.11 99.39 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.3 0.571 . . . . 0.0 109.471 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.64 -1.99 58.32 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.907 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.37 104.23 7.14 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 122.232 -0.292 . . . . 0.0 111.304 -177.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -101.27 91.33 4.46 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.43 0.633 . . . . 0.0 111.212 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -97.26 -13.47 21.97 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.395 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 26.6 m -76.9 141.03 40.71 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.361 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.5 m -51.76 -46.5 64.14 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.891 1.276 . . . . 0.0 112.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 t -112.42 20.62 16.51 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 55.91 17.76 2.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.532 1.133 . . . . 0.0 113.751 -177.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG2' HG23 ' A' ' 27' ' ' VAL . 22.1 ttmm -85.19 115.51 23.02 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.1 t -125.64 138.04 53.9 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -93.33 176.76 6.27 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.498 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 22' ' ' ARG . 19.8 ptt180 -69.81 -2.88 13.37 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.864 0.866 . . . . 0.0 112.366 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -99.33 6.19 46.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 64.39 34.77 10.16 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.957 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.627 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -132.74 144.39 50.25 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 85.5 m -64.69 131.46 46.95 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 19' ' ' LYS . 3.7 m -114.71 135.75 53.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.7 tp -89.99 127.04 55.25 Favored Pre-proline 0 C--N 1.294 -1.816 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.565 -172.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.28 164.06 33.55 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 121.88 1.72 . . . . 0.0 109.772 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -73.73 -18.76 60.95 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 121.359 0.599 . . . . 0.0 111.559 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -94.41 6.38 48.92 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 121.659 0.742 . . . . 0.0 109.531 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -111.89 168.67 12.82 Favored Glycine 0 CA--C 1.505 -0.586 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.646 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 C--N 1.304 -1.203 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.588 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 179.673 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 85.9 m . . . . . 0 C--O 1.244 0.793 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -66.15 168.77 7.97 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.862 173.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 pt -82.58 147.78 5.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.61 -177.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.426 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -114.55 -7.19 12.81 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.986 -177.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -89.5 155.35 19.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -83.51 141.07 31.89 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.1 p -127.61 159.9 33.24 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -132.63 170.44 15.2 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -71.14 -38.11 72.25 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 121.029 0.443 . . . . 0.0 111.364 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -96.81 1.68 50.99 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.96 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.75 88.98 2.81 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 18' ' ' ARG . 26.2 m-20 -110.86 119.9 40.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.373 -176.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -133.49 -4.26 2.96 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.513 0.673 . . . . 0.0 111.633 170.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.5 m -79.04 145.11 34.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 174.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.82 -46.16 67.61 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.649 0.738 . . . . 0.0 111.961 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -83.84 -17.26 41.55 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.611 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.431 ' HG3' ' HB3' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 59.6 22.09 10.73 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.626 0.77 . . . . 0.0 110.713 -174.504 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.69 141.81 33.05 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 113.558 0.948 . . . . 0.0 113.558 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -130.61 138.3 50.05 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 113.068 -1.878 . . . . 0.0 109.014 -178.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.467 HD22 HG13 ' A' ' 27' ' ' VAL . 9.4 p30 -98.24 -176.0 3.28 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.281 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -56.45 -28.52 59.81 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -178.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -81.49 2.0 30.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.072 0.463 . . . . 0.0 110.995 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 69.61 16.56 8.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.986 1.314 . . . . 0.0 110.634 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -97.68 159.55 14.86 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.032 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 49.1 t -72.34 145.04 48.05 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 124.031 0.832 . . . . 0.0 111.154 -175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.467 HG13 HD22 ' A' ' 21' ' ' ASN . 11.4 m -129.29 123.77 58.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 121.507 0.67 . . . . 0.0 110.326 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.97 154.91 84.85 Favored Pre-proline 0 C--N 1.308 -1.227 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.041 -174.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -70.43 164.74 34.1 Favored 'Trans proline' 0 C--O 1.249 1.059 0 C-N-CA 122.496 2.131 . . . . 0.0 110.476 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -68.29 -35.99 78.67 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 m -72.13 -39.56 68.72 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.975 0.417 . . . . 0.0 110.163 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.81 -154.8 34.44 Favored Glycine 0 C--O 1.244 0.774 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.53 29.79 0.13 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.419 -0.896 . . . . 0.0 113.729 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.782 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.802 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.438 -1.073 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -50.43 128.66 20.4 Favored 'General case' 0 C--O 1.254 1.304 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt . . . . . 0 C--O 1.236 0.388 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -164.876 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 4.1 p-10 . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -91.24 -177.28 4.83 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.816 -1.083 . . . . 0.0 108.527 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.435 ' HD2' ' HG2' ' A' ' 25' ' ' LYS . 14.5 mmmm -87.12 135.77 33.17 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.508 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 25.2 p -116.07 138.07 51.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.804 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -131.67 169.27 16.4 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -56.23 -47.02 79.31 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.448 0.468 . . . . 0.0 112.08 -177.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -102.41 12.02 37.15 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.091 0.472 . . . . 0.0 110.626 -173.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.26 99.86 9.23 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.59 101.89 11.01 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-O 121.347 0.594 . . . . 0.0 110.146 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.14 -52.8 1.04 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.462 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.0 m -70.16 115.95 9.95 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -177.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 73.4 m -59.36 -28.47 66.89 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -177.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.4 t -72.6 -35.98 68.0 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.248 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? 59.84 18.32 7.29 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.853 0.861 . . . . 0.0 111.086 -172.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -88.34 112.75 23.22 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.3 m -114.18 151.8 32.16 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 120.849 0.356 . . . . 0.0 111.054 -177.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 p30 -108.9 -176.56 3.07 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.18 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -60.37 -12.06 8.3 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 125.678 1.591 . . . . 0.0 114.119 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -104.17 7.07 36.09 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.3 m120 64.99 26.66 12.71 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.455 1.102 . . . . 0.0 110.269 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HG2' ' HD2' ' A' ' 7' ' ' LYS . 91.6 mttt -103.83 153.43 20.75 Favored 'General case' 0 N--CA 1.42 -1.953 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.15 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.5 m -79.93 145.01 32.86 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.19 164.99 23.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.5 175.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.59 131.15 84.75 Favored Pre-proline 0 C--N 1.309 -1.178 0 O-C-N 123.752 0.657 . . . . 0.0 110.597 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.88 178.68 7.12 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.489 2.126 . . . . 0.0 110.26 176.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.91 -23.38 41.85 Favored 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.5 m -64.45 -34.69 78.78 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.592 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.53 -148.61 18.71 Favored Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.601 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.2 60.82 0.6 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.001 0 C-N-CA 121.274 -0.489 . . . . 0.0 112.443 -178.655 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.6 t . . . . . 0 C--O 1.244 0.77 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.8 ttp180 -66.33 149.16 50.79 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.453 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.5 pt . . . . . 0 C--N 1.35 0.59 0 C-N-CA 124.607 1.163 . . . . 0.0 113.9 -175.285 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 . . . . . 0 CA--C 1.498 -1.03 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.677 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 15.5 mm100 -89.28 167.95 12.65 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.801 -178.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.527 ' O ' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.51 148.18 22.9 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.638 174.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.4 p -137.83 133.52 34.05 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.245 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -137.32 177.16 8.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -71.58 -49.68 38.22 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.984 0.421 . . . . 0.0 110.493 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -88.04 -24.12 23.57 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.428 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.9 86.71 2.64 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -91.06 110.64 21.91 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.677 -176.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -112.72 -52.46 2.78 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.677 ' SG ' ' HB2' ' A' ' 6' ' ' GLN . 69.4 m -86.96 133.63 33.57 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.926 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -25.78 67.8 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.039 0.935 . . . . 0.0 112.138 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 p -78.16 -35.88 48.31 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.046 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 62.03 18.78 10.24 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.19 0.996 . . . . 0.0 110.814 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -86.33 101.39 13.05 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.6 m -108.53 145.65 34.45 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.945 -173.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 p30 -93.0 -178.07 4.69 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.562 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -67.71 -2.65 7.33 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.502 0.721 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -106.34 5.04 29.25 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 120.774 0.321 . . . . 0.0 110.222 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 65.88 24.15 11.29 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.873 0.869 . . . . 0.0 111.156 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -107.2 154.4 21.28 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.3 m -73.89 149.32 41.56 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.8 m -123.05 175.92 5.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.091 174.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.51 HD12 ' HD2' ' A' ' 29' ' ' PRO . 48.0 tp -57.71 119.87 36.89 Favored Pre-proline 0 C--N 1.323 -0.563 0 O-C-N 124.175 0.922 . . . . 0.0 111.391 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.51 ' HD2' HD12 ' A' ' 28' ' ' LEU . 63.2 Cg_endo -74.26 171.27 18.37 Favored 'Trans proline' 0 C--O 1.251 1.153 0 C-N-CA 122.721 2.281 . . . . 0.0 110.691 177.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -69.02 -15.95 63.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.078 0.466 . . . . 0.0 110.178 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.7 m 81.46 112.11 0.06 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.369 1.467 . . . . 0.0 111.941 176.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.27 67.49 0.43 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.47 -65.32 0.89 Allowed Glycine 0 C--N 1.308 -1.021 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.437 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.244 0.807 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -42.91 122.98 2.58 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 124.635 1.174 . . . . 0.0 111.943 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.5 pt . . . . . 0 C--N 1.318 -0.795 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.942 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.4 t30 . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 122.06 0.933 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -78.91 136.15 37.19 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 172.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -82.55 141.52 32.55 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.554 -1.258 . . . . 0.0 111.032 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.0 p -125.31 149.46 48.06 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.435 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 92.9 m-85 -125.97 177.07 6.55 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -58.16 -41.62 84.2 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -174.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -110.0 13.12 23.47 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.223 0.535 . . . . 0.0 110.634 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 7.7 mp -120.33 102.49 8.51 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.842 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -125.98 117.61 23.64 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.697 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -132.46 22.6 4.36 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 106.457 -1.682 . . . . 0.0 106.457 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.4 m -100.45 147.16 26.17 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.482 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.5 m -81.46 -37.89 27.26 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -80.64 -24.89 38.69 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.296 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.4 mtm-85 56.04 28.29 12.6 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.07 0.948 . . . . 0.0 110.943 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -109.66 125.35 52.51 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.515 -176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.1 m -117.88 139.19 51.47 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 p30 -89.43 -174.83 4.51 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 120.834 0.349 . . . . 0.0 110.907 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.4 ptt180 -62.86 -4.87 2.37 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.363 1.465 . . . . 0.0 114.033 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.96 16.3 15.12 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.157 -0.34 . . . . 0.0 110.552 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.8 19.14 11.31 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.204 0.526 . . . . 0.0 111.007 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -92.07 135.31 34.07 Favored 'General case' 0 N--CA 1.428 -1.567 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.0 t -70.93 134.16 47.0 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.8 m -119.65 150.28 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.425 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -77.33 143.45 69.03 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.224 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.425 ' HD2' HD12 ' A' ' 28' ' ' LEU . 40.3 Cg_exo -56.36 110.33 0.56 Allowed 'Trans proline' 0 C--O 1.243 0.728 0 C-N-CA 122.33 2.02 . . . . 0.0 110.397 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -83.54 -26.47 30.09 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 -175.236 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.3 m -81.48 -21.27 38.83 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 121.455 0.645 . . . . 0.0 109.678 -177.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.63 135.21 1.87 Allowed Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.704 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 122.96 2.29 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 119.937 -1.125 . . . . 0.0 112.775 177.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.388 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 177.816 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.915 0 CA-C-O 122.54 1.162 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -103.04 123.35 46.47 Favored 'General case' 0 C--N 1.275 -2.654 0 CA-C-N 112.709 -2.042 . . . . 0.0 105.558 177.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt . . . . . 0 C--O 1.245 0.847 0 O-C-N 123.648 0.592 . . . . 0.0 111.112 -179.175 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 CA--C 1.508 -0.648 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -97.59 162.34 13.34 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.504 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -84.38 132.68 34.56 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.684 0.615 . . . . 0.0 110.488 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -138.29 145.0 40.71 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-O 121.755 0.788 . . . . 0.0 110.661 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.67 -164.96 1.28 Allowed 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -72.33 -46.41 55.72 Favored 'General case' 0 N--CA 1.42 -1.931 0 CA-C-O 120.754 0.311 . . . . 0.0 111.157 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -105.28 -7.22 19.06 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 120.976 0.417 . . . . 0.0 112.098 -176.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mp -114.89 93.81 4.48 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -153.89 138.3 16.73 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -133.76 -0.15 3.18 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.812 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -70.11 131.59 44.52 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.219 -0.301 . . . . 0.0 110.533 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.8 m -58.63 -32.2 68.82 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.462 0.649 . . . . 0.0 110.032 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.25 -36.21 79.38 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.76 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.17 26.51 10.37 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.598 1.159 . . . . 0.0 111.745 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 59.1 tttp -126.34 132.19 51.64 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.1 m -119.96 142.8 48.43 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.203 0.314 . . . . 0.0 110.545 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -90.38 -179.19 5.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -58.47 -29.33 66.12 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -88.53 13.59 11.7 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.706 0.288 . . . . 0.0 111.292 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 m120 64.86 29.81 12.37 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -109.43 147.94 31.99 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.652 -0.819 . . . . 0.0 109.112 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 19' ' ' LYS . 59.7 m -62.7 142.59 58.05 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 124.07 0.856 . . . . 0.0 110.848 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.9 168.78 21.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -88.77 122.93 68.8 Favored Pre-proline 0 C--N 1.312 -1.037 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -81.65 -166.64 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.52 2.814 . . . . 0.0 110.236 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 mp0 -76.31 -33.19 59.04 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.9 p -77.75 -16.76 58.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.273 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.11 -147.16 23.4 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.335 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 115.89 54.1 0.36 Allowed Glycine 0 C--N 1.301 -1.389 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 C-N-CA 121.578 -0.344 . . . . 0.0 113.566 -176.391 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -57.79 141.34 49.21 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--N 1.307 -1.261 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.879 -176.98 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 t30 . . . . . 0 N--CA 1.485 1.299 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.96 145.02 52.03 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -77.45 139.46 39.66 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 p -119.95 133.81 55.44 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -125.33 143.03 51.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 121.254 0.549 . . . . 0.0 111.869 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.434 ' HG3' ' ND1' ' A' ' 11' ' ' HIS . 11.8 pt20 -61.85 -16.18 48.12 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.317 1.047 . . . . 0.0 113.797 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.434 ' ND1' ' HG3' ' A' ' 10' ' ' GLN . 76.1 m80 -112.5 13.72 20.16 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.023 -0.423 . . . . 0.0 111.938 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -121.82 165.19 16.25 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -115.0 30.66 7.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.649 0.738 . . . . 0.0 109.194 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -48.44 -52.53 21.69 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.019 1.328 . . . . 0.0 112.858 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 74.7 m -108.63 152.36 24.9 Favored 'General case' 0 C--N 1.278 -2.514 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.146 176.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -59.55 -45.63 91.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 t -108.37 -15.72 14.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.831 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 82.8 mtm180 49.35 51.01 17.13 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.505 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.45 100.82 4.61 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.7 m -96.55 130.43 43.73 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.02 -173.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.448 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.8 p30 -80.27 -175.87 5.32 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.465 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -67.51 -2.95 7.32 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -115.52 12.65 16.23 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.3 m120 63.66 23.57 13.58 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.944 0.878 . . . . 0.0 110.93 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' HD21 ' A' ' 21' ' ' ASN . 98.4 mttt -96.91 146.12 25.25 Favored 'General case' 0 N--CA 1.411 -2.375 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.129 174.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.3 t -84.71 143.52 29.13 Favored 'General case' 0 C--N 1.256 -3.488 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.448 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 m -125.25 136.48 60.71 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.075 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -55.9 147.33 43.83 Favored Pre-proline 0 C--O 1.244 0.777 0 O-C-N 123.656 0.598 . . . . 0.0 112.169 -174.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.87 136.63 43.54 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.257 2.638 . . . . 0.0 111.349 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -70.25 -9.89 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 p -77.47 -30.3 53.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 121.326 0.584 . . . . 0.0 110.017 172.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.67 168.15 31.04 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.575 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.57 173.86 13.18 Favored Glycine 0 N--CA 1.427 -1.915 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.147 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.108 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 178.401 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.564 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 tpp180 -67.03 127.93 34.45 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 173.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 pt . . . . . 0 C--N 1.311 -1.104 0 O-C-N 123.951 0.782 . . . . 0.0 111.659 -178.69 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 . . . . . 0 N--CA 1.486 1.331 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -79.63 151.88 30.32 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mmmp? -74.46 130.55 39.83 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.069 0.461 . . . . 0.0 112.098 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.452 ' HA ' HD23 ' A' ' 12' ' ' LEU . 26.4 p -114.54 159.04 20.85 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 175.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -146.0 163.48 35.06 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 -177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -75.44 -15.74 60.4 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.162 0.506 . . . . 0.0 112.216 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -101.56 12.13 37.78 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.691 0.757 . . . . 0.0 110.091 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 8' ' ' CYS . 33.9 tp -120.03 149.61 41.88 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.23 19.44 2.77 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.509 -1.276 . . . . 0.0 112.369 -174.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.564 ' HB3' ' HB2' ' A' ' 2' ' ' ARG . 7.9 m-20 -67.71 -17.07 64.44 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.0 m -85.76 110.36 19.29 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.5 m -53.33 -44.78 68.73 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.6 t -102.56 9.88 39.16 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.475 0.655 . . . . 0.0 110.139 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' ARG . 4.5 mpt_? 59.08 31.25 21.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.104 0.962 . . . . 0.0 111.63 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.45 120.14 25.09 Favored 'General case' 0 CA--C 1.501 -0.927 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.254 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.5 m -131.02 148.93 52.81 Favored 'General case' 0 C--N 1.275 -2.67 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.594 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -88.41 176.92 6.98 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -66.39 -15.14 63.07 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -95.89 6.19 49.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 120.734 0.302 . . . . 0.0 111.122 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 71.69 32.66 1.93 Allowed 'General case' 0 C--O 1.26 1.619 0 C-N-CA 123.877 0.871 . . . . 0.0 112.185 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.82 149.25 25.22 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 172.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 21.2 t -78.93 135.15 36.88 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 m -118.21 145.28 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 CA-C-O 120.958 0.408 . . . . 0.0 110.436 177.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.474 HD12 ' HD2' ' A' ' 29' ' ' PRO . 29.2 tp -67.82 127.28 93.35 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.921 -171.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.474 ' HD2' HD12 ' A' ' 28' ' ' LEU . 78.3 Cg_endo -82.83 175.87 8.24 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.773 2.315 . . . . 0.0 111.42 175.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -92.12 -48.26 6.81 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.154 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.7 m -59.94 -48.32 82.17 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -115.52 149.59 18.82 Favored Glycine 0 N--CA 1.434 -1.44 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.549 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.24 -27.78 5.18 Favored Glycine 0 C--N 1.306 -1.092 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.774 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 CA-C-O 121.505 0.503 . . . . 0.0 111.986 -178.018 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 122.309 1.052 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.491 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 17.6 tpp180 -100.01 139.19 36.04 Favored 'General case' 0 C--N 1.273 -2.755 0 CA-C-N 113.823 -1.535 . . . . 0.0 106.914 168.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.8 pt . . . . . 0 C--O 1.246 0.909 0 O-C-N 123.267 0.354 . . . . 0.0 110.701 177.663 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -84.06 158.38 21.46 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -80.74 126.08 30.86 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 120.736 0.303 . . . . 0.0 110.46 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 p -131.12 138.59 49.58 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -129.95 175.77 8.6 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -64.16 -19.93 65.65 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -118.22 13.47 13.74 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.399 0.619 . . . . 0.0 110.045 175.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -135.21 35.07 3.03 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.467 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 11.1 m-20 -79.44 87.59 5.06 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.802 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -87.78 -12.71 44.29 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.797 0.808 . . . . 0.0 109.814 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.491 ' SG ' ' HB3' ' A' ' 2' ' ' ARG . 29.7 m -81.16 118.22 22.37 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 173.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.6 m -63.86 -32.84 74.49 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -169.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -81.86 -7.94 59.64 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.592 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.467 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 77.6 mtp180 57.52 28.54 15.7 Favored 'General case' 0 C--N 1.358 0.936 0 C-N-CA 124.877 1.271 . . . . 0.0 111.413 -176.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.6 tttm -83.16 100.53 10.61 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -128.1 144.79 51.13 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.651 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -89.39 -179.1 5.76 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 120.964 0.412 . . . . 0.0 111.301 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -63.47 -18.07 63.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -93.58 5.24 52.27 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.134 0.492 . . . . 0.0 109.717 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 68.52 24.39 7.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.306 1.043 . . . . 0.0 110.882 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -97.11 135.83 38.52 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.3 t -68.05 135.98 53.1 Favored 'General case' 0 C--N 1.287 -2.145 0 O-C-N 123.559 0.537 . . . . 0.0 109.653 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.2 m -117.62 143.03 29.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 CA-C-O 120.601 0.239 . . . . 0.0 110.544 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.414 HD12 ' HD2' ' A' ' 29' ' ' PRO . 35.4 tp -67.48 125.51 91.27 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.845 -172.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.414 ' HD2' HD12 ' A' ' 28' ' ' LEU . 6.7 Cg_exo -69.11 107.87 1.83 Allowed 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.672 2.248 . . . . 0.0 108.72 170.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -15.62 62.2 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.252 0.549 . . . . 0.0 112.056 -174.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -112.51 9.52 19.56 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.037 0.922 . . . . 0.0 108.936 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -145.23 -133.54 2.61 Favored Glycine 0 N--CA 1.435 -1.37 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -157.89 152.14 23.34 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.489 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.034 -178.132 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' HG ' ' A' ' 28' ' ' LEU . 33.6 m . . . . . 0 N--CA 1.443 -0.812 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.4 HH21 ' CG ' ' A' ' 14' ' ' ASP . 4.1 tpp180 -62.11 136.28 57.88 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 173.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 pt . . . . . 0 C--O 1.254 1.342 0 O-C-N 123.753 0.658 . . . . 0.0 111.941 178.764 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 120.704 0.288 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -76.09 164.65 25.91 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 27.6 mtpp -78.38 171.23 15.39 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.137 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -117.83 133.46 55.91 Favored 'General case' 0 C--N 1.285 -2.225 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -125.53 160.55 29.26 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -62.14 -25.57 67.82 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 123.489 0.716 . . . . 0.0 112.462 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -101.92 6.23 41.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.702 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.7 tp -97.65 95.16 7.4 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.236 0.541 . . . . 0.0 110.175 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -97.02 10.89 37.98 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.539 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.4 ' CG ' HH21 ' A' ' 2' ' ' ARG . 14.1 t70 -78.41 -23.79 46.55 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.448 1.118 . . . . 0.0 108.443 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.1 m -79.88 107.49 12.7 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 170.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.3 m -52.31 -47.09 66.14 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.716 0.635 . . . . 0.0 112.665 -169.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.7 m -98.85 4.83 47.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.771 -177.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 53.37 30.78 10.82 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.449 0.7 . . . . 0.0 110.358 -175.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -83.26 130.72 35.09 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.112 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 63.7 m -120.17 151.68 38.76 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.217 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' LYS . 39.5 p30 -99.89 -176.16 3.17 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 174.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -62.61 -11.92 19.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.9 12.03 29.29 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 121.888 -0.507 . . . . 0.0 110.745 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 66.28 25.13 10.56 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 122.136 0.969 . . . . 0.0 108.95 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 68.3 mttm -93.81 160.4 14.76 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.572 176.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -84.67 143.93 28.9 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.0 m -140.22 154.2 22.77 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 CA-C-O 120.97 0.414 . . . . 0.0 110.036 175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.436 ' HG ' ' HB2' ' A' ' 1' ' ' CYS . 7.8 mp -90.29 154.73 46.85 Favored Pre-proline 0 C--N 1.305 -1.365 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.06 179.95 5.26 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 122.291 1.994 . . . . 0.0 111.01 174.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.56 -32.16 73.08 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 122.79 0.436 . . . . 0.0 111.412 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.9 p -83.58 2.73 35.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.59 -113.29 4.17 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.366 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.14 170.9 29.69 Favored Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.304 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 179.335 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.955 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -46.87 123.59 5.34 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.552 1.141 . . . . 0.0 110.612 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt . . . . . 0 C--N 1.321 -0.642 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -174.927 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 C--O 1.234 0.248 0 CA-C-O 122.238 1.018 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -83.83 168.34 16.22 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.309 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -86.83 132.37 33.85 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.663 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 27.7 p -115.0 141.55 47.84 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -148.08 157.26 43.41 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.57 -35.64 80.14 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.187 0.518 . . . . 0.0 111.241 -176.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.0 p-80 -95.89 11.28 34.37 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.882 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.8 tp -114.4 111.97 22.28 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 121.663 0.744 . . . . 0.0 109.086 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -94.86 15.72 17.84 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.704 -174.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -60.79 -48.79 80.22 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.721 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.0 m -90.24 127.4 36.13 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.78 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.4 m -50.55 -42.2 55.08 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 125.832 1.653 . . . . 0.0 112.687 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 29' ' ' PRO . 29.9 p -83.66 -23.13 31.91 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? 61.61 16.39 7.66 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.18 0.592 . . . . 0.0 110.86 -172.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 13.7 mmmm -90.74 150.71 21.51 Favored 'General case' 0 CA--C 1.48 -1.73 0 O-C-N 122.086 -0.384 . . . . 0.0 110.98 -177.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.4 m -127.09 142.57 51.49 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-N 114.556 -1.202 . . . . 0.0 112.277 -173.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.453 HD21 ' HB2' ' A' ' 25' ' ' LYS . 33.5 p30 -104.31 -177.66 3.43 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.324 174.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -62.64 -15.22 50.93 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -100.18 5.59 44.77 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 121.998 -0.439 . . . . 0.0 111.487 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 t30 71.64 17.04 5.66 Favored 'General case' 0 N--CA 1.505 2.317 0 CA-C-O 123.394 1.568 . . . . 0.0 108.9 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.9 mttm -94.53 158.32 15.59 Favored 'General case' 0 N--CA 1.415 -2.213 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.297 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.663 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.0 m -74.51 150.88 39.62 Favored 'General case' 0 C--N 1.281 -2.407 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.123 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' LYS . 3.0 m -130.57 116.96 37.26 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.348 0.594 . . . . 0.0 109.477 170.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 24.6 tp -90.29 142.68 28.61 Favored Pre-proline 0 C--N 1.289 -2.031 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 17' ' ' SER . 85.0 Cg_exo -51.77 154.61 9.3 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 123.099 2.532 . . . . 0.0 113.028 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.46 -22.93 35.0 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.4 p -77.85 87.89 4.06 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 123.95 -97.25 0.55 Allowed Glycine 0 N--CA 1.423 -2.223 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.99 -13.83 63.62 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 121.212 -0.518 . . . . 0.0 113.602 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.18 0 C-N-CA 121.37 -0.443 . . . . 0.0 112.747 -176.767 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.435 -1.222 0 CA-C-O 121.224 0.535 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -69.68 135.39 49.8 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.507 HG13 ' HG2' ' A' ' 6' ' ' GLN . 30.0 pt . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 . . . . . 0 C--O 1.238 0.479 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.507 ' HG2' HG13 ' A' ' 3' ' ' ILE . 84.3 mm-40 -83.4 152.07 25.2 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 120.647 0.261 . . . . 0.0 110.418 177.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.42 122.51 27.59 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.392 178.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 26' ' ' CYS . 25.3 p -129.15 155.75 45.0 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -122.37 -174.31 2.88 Favored 'General case' 0 C--N 1.293 -1.863 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.298 -176.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -69.41 -40.02 77.58 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -175.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -105.38 -21.55 13.21 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.302 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 mp -114.09 103.6 11.29 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.068 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.466 ' OD1' ' HA ' ' A' ' 18' ' ' ARG . 1.6 p30 -148.93 163.0 38.74 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -133.1 31.44 3.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.2 m -95.92 139.06 32.67 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.883 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 m -60.3 -37.97 82.19 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 121.549 0.69 . . . . 0.0 110.651 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -85.97 -10.32 55.33 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.72 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.466 ' HA ' ' OD1' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 62.07 17.86 9.47 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.583 1.153 . . . . 0.0 110.949 -174.733 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -105.18 140.94 37.58 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 121.774 0.797 . . . . 0.0 112.233 -173.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.7 m -131.2 147.87 52.64 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -84.52 -175.27 5.71 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 118.476 0.58 . . . . 0.0 110.001 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -68.63 -8.23 40.26 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -103.46 7.16 37.93 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m120 63.58 32.15 14.21 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 124.024 0.929 . . . . 0.0 112.295 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -92.33 138.48 31.48 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 174.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.459 ' HA ' ' SG ' ' A' ' 8' ' ' CYS . 42.5 t -62.76 113.98 3.35 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 124.024 0.827 . . . . 0.0 110.712 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . 0.255 24.8 m -105.24 102.69 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 CA-C-O 122.842 1.306 . . . . 0.0 112.374 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.21 155.77 91.51 Favored Pre-proline 0 C--N 1.3 -1.55 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.674 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -75.47 174.09 13.39 Favored 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 120.876 1.051 . . . . 0.0 109.938 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -66.93 -29.91 69.91 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.672 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -63.72 -25.09 68.04 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.062 176.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.37 -137.21 34.96 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 128.99 -164.94 21.94 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.239 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 177.4 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.3 ttm-85 -51.6 124.65 12.71 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 119.457 1.026 . . . . 0.0 112.144 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.0 -178.79 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 . . . . . 0 N--CA 1.484 1.257 0 CA-C-O 121.271 0.558 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -69.55 153.78 42.97 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -77.92 159.31 28.95 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.492 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 18.0 p -123.26 150.98 42.82 Favored 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 112.943 -1.935 . . . . 0.0 106.009 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.4 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 90.1 m-85 -126.48 174.05 8.93 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.02 -44.88 91.77 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 123.833 0.708 . . . . 0.0 111.463 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -118.43 -30.68 5.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.808 175.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 6.9 mp -77.78 92.37 4.19 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.873 0.844 . . . . 0.0 111.521 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -127.42 118.2 23.62 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.082 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -123.79 12.98 9.21 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 122.861 1.315 . . . . 0.0 107.931 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m -83.86 111.1 18.91 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 m -57.38 -26.14 60.59 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 123.477 0.711 . . . . 0.0 111.786 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 p -71.45 -27.87 63.56 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.427 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 54.8 21.84 3.83 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 125.077 1.351 . . . . 0.0 113.361 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -119.88 125.22 47.97 Favored 'General case' 0 N--CA 1.415 -2.205 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.407 ' SG ' ' HA ' ' A' ' 24' ' ' ASN . 42.6 t -130.67 142.9 50.44 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.9 p30 -90.01 178.2 6.26 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 120.975 0.417 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -64.26 -18.67 64.78 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -88.62 0.97 55.84 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.675 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.407 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.9 OUTLIER 73.74 27.67 1.7 Allowed 'General case' 0 C--O 1.246 0.894 0 C-N-CA 124.15 0.98 . . . . 0.0 111.454 178.098 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -106.6 129.72 54.48 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 71.1 m -70.38 135.35 48.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.7 m -123.02 150.98 27.09 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.357 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.0 tp -90.01 141.32 27.9 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 -176.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.55 175.64 8.47 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 121.775 1.65 . . . . 0.0 112.627 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -28.93 70.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.476 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -78.28 -3.08 41.1 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.855 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.33 -145.68 29.58 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.795 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 146.55 140.26 3.43 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.538 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.437 -1.125 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -61.46 130.89 48.2 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 117.71 0.232 . . . . 0.0 110.384 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.49 ' H ' HD13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.241 0.649 0 O-C-N 124.043 0.839 . . . . 0.0 113.096 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.2 m120 . . . . . 0 CA--C 1.491 -1.289 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.436 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.3 mm-40 -99.09 175.59 5.85 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.985 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 150.17 21.81 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.281 -178.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.2 p -147.16 161.22 41.34 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.488 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 91.8 m-85 -134.06 -170.86 2.6 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -70.04 -49.4 51.66 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -103.11 -4.04 25.04 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.923 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 79.9 mt -99.92 94.03 6.08 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.408 ' HB3' ' HG2' ' A' ' 18' ' ' ARG . 11.5 m-20 -95.36 80.14 3.5 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.515 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.57 -49.21 56.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.68 0.753 . . . . 0.0 109.171 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -80.06 141.94 35.38 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.125 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.19 -21.84 62.1 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 124.183 0.993 . . . . 0.0 110.513 -175.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.7 p -70.24 -28.08 64.97 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.308 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HG2' ' HB3' ' A' ' 13' ' ' ASP . 76.7 mtp180 57.0 26.88 12.43 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.489 1.116 . . . . 0.0 111.49 -177.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -121.08 120.58 35.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.039 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.4 m -109.69 151.43 26.9 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.16 -178.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -103.16 -173.75 2.39 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -68.22 -11.33 59.12 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -94.06 1.67 56.15 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 68.13 22.44 8.31 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 122.403 1.097 . . . . 0.0 110.368 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -106.7 163.74 12.66 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.282 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.7 m -79.86 148.57 31.28 Favored 'General case' 0 C--N 1.284 -2.264 0 O-C-N 123.433 0.458 . . . . 0.0 110.779 -177.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.1 m -126.4 170.52 16.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.324 173.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.87 131.29 70.65 Favored Pre-proline 0 N--CA 1.434 -1.266 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.53 159.67 28.73 Favored 'Trans proline' 0 N--CA 1.444 -1.416 0 C-N-CA 122.154 1.903 . . . . 0.0 110.784 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.87 -16.98 62.15 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.738 0.78 . . . . 0.0 110.066 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.6 p -81.22 -0.32 40.07 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.81 -90.49 1.66 Allowed Glycine 0 N--CA 1.431 -1.667 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 88.73 -174.91 43.29 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.485 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.575 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.853 0.835 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.18 140.35 30.23 Favored 'General case' 0 C--N 1.264 -3.123 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.559 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 12.8 pt . . . . . 0 C--N 1.316 -0.89 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.675 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 . . . . . 0 CA--C 1.512 -0.498 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.48 141.97 51.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.75 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.517 ' N ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -67.86 145.66 54.41 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 167.661 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -115.94 145.29 43.05 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 117.443 -1.703 . . . . 0.0 113.382 -176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -137.39 133.36 34.7 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -55.26 -33.7 63.4 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -99.96 5.89 45.19 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.6 mt -91.34 139.73 30.45 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.533 -0.867 . . . . 0.0 111.444 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -82.71 -8.6 59.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.723 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -52.17 -39.44 60.06 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.329 1.052 . . . . 0.0 109.484 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 59.1 m -92.65 99.54 12.22 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.402 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.3 m -58.4 -37.4 75.24 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.49 0.662 . . . . 0.0 109.916 176.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 m -75.92 -23.72 55.49 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.8 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 53.14 23.23 2.95 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.292 1.037 . . . . 0.0 113.371 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.43 140.44 49.14 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -128.23 151.97 48.64 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.869 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -94.94 174.95 6.84 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -64.03 -12.25 36.76 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -99.86 9.95 42.14 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 122.439 -0.163 . . . . 0.0 111.288 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 t30 72.3 17.22 4.93 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 124.403 1.081 . . . . 0.0 111.269 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -93.38 146.88 23.41 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.1 t -87.97 112.52 22.66 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.3 m -102.2 162.96 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 121.392 0.615 . . . . 0.0 112.29 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.03 139.32 79.58 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.56 156.32 42.72 Favored 'Trans proline' 0 C--O 1.24 0.577 0 C-N-CA 122.304 2.003 . . . . 0.0 110.539 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.09 -20.7 62.32 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.702 0.287 . . . . 0.0 111.385 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -88.4 -9.44 52.61 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.924 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 116.61 -143.4 18.04 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.815 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.42 -148.85 19.2 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.453 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.49 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.291 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' HD3' ' A' ' 29' ' ' PRO . 18.3 t . . . . . 0 C--O 1.247 0.957 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -59.52 178.43 0.15 Allowed 'General case' 0 C--O 1.251 1.16 0 CA-C-O 122.312 1.053 . . . . 0.0 111.566 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.462 HG13 ' HG2' ' A' ' 6' ' ' GLN . 15.6 pt . . . . . 0 C--N 1.295 -1.764 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 . . . . . 0 N--CA 1.442 -0.859 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.462 ' HG2' HG13 ' A' ' 3' ' ' ILE . 15.8 mm100 -64.42 142.18 58.51 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -93.03 124.14 36.79 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.28 151.08 52.0 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -128.75 -165.38 1.5 Allowed 'General case' 0 C--N 1.285 -2.202 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -73.74 -49.74 24.08 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.615 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -90.68 -29.91 17.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.251 0.548 . . . . 0.0 110.345 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.27 82.43 5.46 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.49 ' CG ' ' HG2' ' A' ' 18' ' ' ARG . 13.2 t70 -105.79 137.13 44.19 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.57 -178.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -128.91 -0.35 5.32 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.488 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 64.0 m -95.48 177.23 5.89 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.472 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -80.38 -33.38 37.21 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.819 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 m -134.89 24.46 3.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.607 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HG2' ' CG ' ' A' ' 13' ' ' ASP . 58.9 mtm180 50.12 24.57 1.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 124.07 0.948 . . . . 0.0 112.808 -175.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -85.2 107.58 17.32 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.914 0.864 . . . . 0.0 111.821 -177.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 m -117.92 136.48 53.45 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.574 -1.648 . . . . 0.0 108.819 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -81.05 -177.73 6.57 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 120.757 0.313 . . . . 0.0 110.947 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.46 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -56.31 -21.0 21.38 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -101.39 7.61 42.57 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.913 -0.492 . . . . 0.0 110.456 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.0 m120 66.23 25.67 10.55 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 123.943 0.897 . . . . 0.0 112.786 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -90.38 142.3 27.87 Favored 'General case' 0 N--CA 1.422 -1.828 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.556 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.4 t -67.07 125.46 26.07 Favored 'General case' 0 C--N 1.286 -2.155 0 O-C-N 124.654 1.221 . . . . 0.0 109.317 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.9 m -115.03 176.08 2.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-O 120.997 0.427 . . . . 0.0 111.008 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.61 148.7 87.95 Favored Pre-proline 0 C--N 1.303 -1.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.029 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 1' ' ' CYS . 61.0 Cg_endo -74.42 172.26 16.47 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.656 2.238 . . . . 0.0 112.241 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -103.81 -26.04 12.86 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.646 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 m -85.18 -48.21 9.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.483 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -93.74 -178.41 39.41 Favored Glycine 0 C--O 1.244 0.725 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.915 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.62 -69.59 0.98 Allowed Glycine 0 C--O 1.243 0.688 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.511 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.258 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -58.97 160.98 5.37 Favored 'General case' 0 C--O 1.249 1.028 0 C-N-CA 123.061 0.544 . . . . 0.0 111.069 175.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 pt . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.017 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 CA--C 1.502 -0.894 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -79.06 147.45 32.8 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.812 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.462 ' HE3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -88.9 149.11 23.49 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 176.617 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.3 p -145.1 141.5 28.87 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -119.46 172.05 7.91 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -54.23 -41.51 68.8 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -105.78 3.58 28.97 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.446 0.641 . . . . 0.0 110.798 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.4 mt -124.11 75.01 1.34 Allowed 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.082 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.407 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 8.2 m-20 -100.24 113.84 26.83 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.008 -178.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -113.1 -10.37 13.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.584 0.706 . . . . 0.0 110.161 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.4 m -71.9 139.46 48.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -54.18 -46.21 72.31 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.951 0.9 . . . . 0.0 111.711 -175.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t -101.33 13.69 34.3 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.407 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 83.3 mtp180 51.65 30.89 7.13 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.345 1.058 . . . . 0.0 112.023 -176.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -94.01 113.71 25.75 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.5 -172.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -125.11 136.55 53.75 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -85.37 -171.75 3.78 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.989 0.423 . . . . 0.0 111.788 -178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -66.83 -10.1 44.45 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.466 0.706 . . . . 0.0 112.785 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -108.15 11.03 27.84 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.48 25.18 15.0 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.536 0.735 . . . . 0.0 111.445 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -94.71 145.69 24.68 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -71.5 135.79 47.28 Favored 'General case' 0 C--N 1.283 -2.29 0 O-C-N 124.572 1.17 . . . . 0.0 108.417 -177.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.1 m -129.72 137.06 57.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 121.385 0.612 . . . . 0.0 111.523 178.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.457 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -73.07 128.11 88.32 Favored Pre-proline 0 C--N 1.305 -1.368 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 176.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 28' ' ' LEU . 18.8 Cg_endo -58.87 161.23 15.87 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.562 2.175 . . . . 0.0 111.823 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.42 -9.22 55.81 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.859 -175.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.3 p -69.78 -29.23 66.51 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.241 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.18 -151.69 20.86 Favored Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.544 -1.023 . . . . 0.0 110.544 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.5 30.54 Favored Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.889 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.986 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.375 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.516 ' SG ' ' HA ' ' A' ' 31' ' ' THR . 63.1 m . . . . . 0 N--CA 1.437 -1.121 0 CA-C-O 120.645 0.259 . . . . 0.0 110.77 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -64.19 152.31 41.08 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.902 0.881 . . . . 0.0 110.933 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.5 pt . . . . . 0 C--N 1.316 -0.857 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.381 175.872 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 121.028 0.442 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -72.93 158.58 35.21 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.819 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -90.0 113.95 25.71 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.93 146.74 52.06 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-O 121.673 0.749 . . . . 0.0 110.558 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.08 -173.53 2.92 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -66.51 -49.77 65.43 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.283 0.564 . . . . 0.0 110.285 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -85.36 -27.17 26.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 110.315 -178.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.2 mp -98.67 79.03 2.4 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.005 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 8.7 p-10 -93.47 126.38 38.59 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -117.77 3.27 12.28 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.403 -176.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.1 m -130.83 149.75 52.32 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 121.792 -0.567 . . . . 0.0 110.862 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -51.79 -46.49 64.21 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.145 0.978 . . . . 0.0 112.4 -178.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -84.42 -3.55 58.4 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.986 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.44 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 74.6 mtt180 51.32 29.08 4.74 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.261 1.025 . . . . 0.0 112.416 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HE2' HG23 ' A' ' 27' ' ' VAL . 19.4 ptmt -94.77 126.54 40.15 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-O 122.205 1.002 . . . . 0.0 110.907 -176.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -127.96 141.79 51.43 Favored 'General case' 0 C--N 1.257 -3.433 0 CA-C-N 113.68 -1.6 . . . . 0.0 108.237 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -82.51 -176.51 6.27 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -65.95 -11.24 46.03 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.12 4.09 31.02 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 122.31 -0.244 . . . . 0.0 110.941 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m120 76.26 22.3 1.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.683 0.793 . . . . 0.0 112.495 -178.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -96.79 131.37 43.58 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.4 t -62.71 131.19 48.11 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.707 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.456 HG23 ' HE2' ' A' ' 19' ' ' LYS . 1.8 m -102.34 167.13 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.69 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.311 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.415 ' H ' HD12 ' A' ' 28' ' ' LEU . 5.1 mp -58.52 114.28 8.48 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -169.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.91 162.89 38.27 Favored 'Trans proline' 0 C--O 1.243 0.77 0 C-N-CA 123.351 2.701 . . . . 0.0 112.541 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.25 -30.98 71.49 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.86 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.516 ' HA ' ' SG ' ' A' ' 1' ' ' CYS . 31.1 m 74.96 107.31 0.07 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.199 1.399 . . . . 0.0 112.599 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.12 66.06 0.42 Allowed Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.11 -69.51 3.28 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.177 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 178.623 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.441 -0.913 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.96 133.4 56.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 118.156 0.434 . . . . 0.0 109.98 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.4 pt . . . . . 0 CA--C 1.559 1.316 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -173.62 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.8 t30 . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 122.419 1.104 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -90.03 140.8 29.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -72.0 141.42 49.36 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 123.282 0.364 . . . . 0.0 111.409 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.5 p -118.92 163.87 16.29 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.526 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 50.0 m-85 -134.96 158.58 43.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.48 -26.83 68.74 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.554 0.692 . . . . 0.0 110.246 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -110.86 16.17 21.43 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.334 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.526 ' HB3' ' HB2' ' A' ' 9' ' ' PHE . 37.6 tp -142.27 104.84 4.5 Favored 'General case' 0 N--CA 1.426 -1.632 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.727 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -109.07 117.26 33.72 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.625 0.726 . . . . 0.0 110.153 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -132.68 27.96 4.3 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.66 163.65 13.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.885 -1.507 . . . . 0.0 111.998 -173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.5 m -83.99 -46.26 12.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.617 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 m -96.47 -3.96 42.45 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.761 -174.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 54.87 21.34 3.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -107.2 141.77 37.96 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.067 -175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.87 152.09 28.35 Favored 'General case' 0 C--N 1.283 -2.32 0 CA-C-N 114.893 -1.049 . . . . 0.0 108.847 176.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.41 -179.63 4.98 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 174.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -67.59 -7.25 24.79 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 123.026 0.53 . . . . 0.0 112.226 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -102.71 5.17 38.81 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.18 -179.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.3 t30 70.5 20.12 6.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 123.21 1.481 . . . . 0.0 110.622 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -100.02 153.24 19.36 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.612 -1.177 . . . . 0.0 108.133 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.78 129.08 36.23 Favored 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.6 m -130.83 149.99 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.656 -177.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.5 tp -88.8 124.25 65.88 Favored Pre-proline 0 C--N 1.306 -1.307 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 172.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -74.71 -171.55 0.98 Allowed 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 122.029 1.819 . . . . 0.0 111.638 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -66.05 -23.98 66.64 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.246 0.546 . . . . 0.0 110.925 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.3 p -84.69 102.55 13.06 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 145.5 147.68 4.66 Favored Glycine 0 N--CA 1.431 -1.697 0 N-CA-C 110.214 -1.154 . . . . 0.0 110.214 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.89 -38.27 6.54 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.938 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.787 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.521 ' HD2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.73 166.46 13.05 Favored 'General case' 0 C--O 1.249 1.029 0 C-N-CA 120.824 -0.351 . . . . 0.0 110.435 173.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.8 pt . . . . . 0 CA--C 1.543 0.699 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.574 -178.516 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 . . . . . 0 CA--C 1.514 -0.415 0 CA-C-O 120.768 0.318 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.517 ' HG3' ' HB3' ' A' ' 2' ' ' ARG . 16.1 mm100 -75.95 152.97 36.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.053 0.454 . . . . 0.0 110.876 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -94.92 116.81 29.18 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.7 p -118.45 160.99 20.74 Favored 'General case' 0 C--N 1.275 -2.653 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.01 -176.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -134.52 155.47 50.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -63.77 -27.7 69.37 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.396 0.617 . . . . 0.0 111.764 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -98.31 16.25 22.08 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.649 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 47.2 tp -136.45 108.25 7.07 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-O 120.917 0.389 . . . . 0.0 110.092 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -82.61 73.89 9.62 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.676 1.227 . . . . 0.0 111.512 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.521 ' O ' ' HD2' ' A' ' 2' ' ' ARG . 33.8 t70 -95.39 -29.07 14.63 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 174.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.1 m -109.92 135.47 50.73 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.9 m -50.45 -47.41 56.85 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -94.32 2.58 55.83 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.882 -173.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 55.0 30.32 13.94 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.556 0.693 . . . . 0.0 110.974 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -84.92 116.12 23.17 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.457 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 24' ' ' ASN . 63.4 m -129.36 145.61 51.37 Favored 'General case' 0 C--N 1.277 -2.562 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.167 -177.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.402 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.2 p30 -83.51 -174.48 5.31 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -63.01 -16.42 59.75 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -102.61 12.17 36.75 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 20' ' ' CYS 0.306 3.3 p-10 50.46 36.91 14.4 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.894 1.678 . . . . 0.0 112.066 -175.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.8 mttm -91.3 153.97 19.57 Favored 'General case' 0 N--CA 1.424 -1.754 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.4 t -71.86 130.97 42.34 Favored 'General case' 0 C--N 1.286 -2.175 0 O-C-N 123.855 0.722 . . . . 0.0 112.01 -172.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.4 m -124.5 113.98 38.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.812 0.815 . . . . 0.0 110.262 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.4 tp -71.26 129.88 88.53 Favored Pre-proline 0 C--N 1.31 -1.139 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.352 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.478 ' HD2' HD12 ' A' ' 28' ' ' LEU . 10.5 Cg_endo -53.46 110.08 0.44 Allowed 'Trans proline' 0 C--N 1.367 1.512 0 C-N-CA 123.38 2.72 . . . . 0.0 112.218 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 60.2 18.22 7.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.73 1.212 . . . . 0.0 112.289 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 m 58.37 38.39 25.81 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-O 122.124 0.964 . . . . 0.0 109.542 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -151.06 94.85 0.15 Allowed Glycine 0 N--CA 1.435 -1.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.76 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.3 154.17 19.68 Favored Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.38 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 178.405 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.85 149.2 44.9 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.4 pt . . . . . 0 C--N 1.311 -1.076 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.936 -177.184 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.7 m-20 . . . . . 0 N--CA 1.472 0.639 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -81.84 150.97 27.56 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -89.96 167.51 12.74 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.588 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.9 p -154.21 147.77 25.17 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.203 -176.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -135.29 175.63 9.41 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.1 -43.11 99.39 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.3 0.571 . . . . 0.0 109.471 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.64 -1.99 58.32 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.907 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.37 104.23 7.14 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 122.232 -0.292 . . . . 0.0 111.304 -177.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -101.27 91.33 4.46 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.43 0.633 . . . . 0.0 111.212 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -97.26 -13.47 21.97 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.395 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 26.6 m -76.9 141.03 40.71 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.361 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.5 m -51.76 -46.5 64.14 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.891 1.276 . . . . 0.0 112.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 t -112.42 20.62 16.51 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 55.91 17.76 2.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.532 1.133 . . . . 0.0 113.751 -177.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG2' HG23 ' A' ' 27' ' ' VAL . 22.1 ttmm -85.19 115.51 23.02 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.1 t -125.64 138.04 53.9 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -93.33 176.76 6.27 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.498 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 22' ' ' ARG . 19.8 ptt180 -69.81 -2.88 13.37 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.864 0.866 . . . . 0.0 112.366 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -99.33 6.19 46.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 64.39 34.77 10.16 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.957 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.627 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -132.74 144.39 50.25 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 85.5 m -64.69 131.46 46.95 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 19' ' ' LYS . 3.7 m -114.71 135.75 53.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.7 tp -89.99 127.04 55.25 Favored Pre-proline 0 C--N 1.294 -1.816 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.565 -172.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.28 164.06 33.55 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 121.88 1.72 . . . . 0.0 109.772 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -73.73 -18.76 60.95 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 121.359 0.599 . . . . 0.0 111.559 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -94.41 6.38 48.92 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 121.659 0.742 . . . . 0.0 109.531 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -111.89 168.67 12.82 Favored Glycine 0 CA--C 1.505 -0.586 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.646 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 C--N 1.304 -1.203 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.588 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 179.673 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 85.9 m . . . . . 0 C--O 1.244 0.793 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -66.15 168.77 7.97 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.862 173.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 pt . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.61 -177.031 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.1 m120 . . . . . 0 CA--C 1.502 -0.881 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -89.5 155.35 19.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -83.51 141.07 31.89 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.1 p -127.61 159.9 33.24 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -132.63 170.44 15.2 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.14 -38.11 72.25 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 121.029 0.443 . . . . 0.0 111.364 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -96.81 1.68 50.99 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.96 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.75 88.98 2.81 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 18' ' ' ARG . 26.2 m-20 -110.86 119.9 40.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.373 -176.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -133.49 -4.26 2.96 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.513 0.673 . . . . 0.0 111.633 170.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.5 m -79.04 145.11 34.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 174.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.82 -46.16 67.61 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.649 0.738 . . . . 0.0 111.961 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -83.84 -17.26 41.55 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.611 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.431 ' HG3' ' HB3' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 59.6 22.09 10.73 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.626 0.77 . . . . 0.0 110.713 -174.504 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.69 141.81 33.05 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 113.558 0.948 . . . . 0.0 113.558 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -130.61 138.3 50.05 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 113.068 -1.878 . . . . 0.0 109.014 -178.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.467 HD22 HG13 ' A' ' 27' ' ' VAL . 9.4 p30 -98.24 -176.0 3.28 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.281 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -56.45 -28.52 59.81 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -178.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -81.49 2.0 30.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.072 0.463 . . . . 0.0 110.995 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 69.61 16.56 8.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.986 1.314 . . . . 0.0 110.634 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -97.68 159.55 14.86 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.032 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.1 t -72.34 145.04 48.05 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 124.031 0.832 . . . . 0.0 111.154 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.467 HG13 HD22 ' A' ' 21' ' ' ASN . 11.4 m -129.29 123.77 58.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 121.507 0.67 . . . . 0.0 110.326 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.97 154.91 84.85 Favored Pre-proline 0 C--N 1.308 -1.227 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.041 -174.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -70.43 164.74 34.1 Favored 'Trans proline' 0 C--O 1.249 1.059 0 C-N-CA 122.496 2.131 . . . . 0.0 110.476 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -68.29 -35.99 78.67 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 m -72.13 -39.56 68.72 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.975 0.417 . . . . 0.0 110.163 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.81 -154.8 34.44 Favored Glycine 0 C--O 1.244 0.774 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.53 29.79 0.13 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.419 -0.896 . . . . 0.0 113.729 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.782 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.802 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.438 -1.073 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -50.43 128.66 20.4 Favored 'General case' 0 C--O 1.254 1.304 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.479 ' HA ' HD23 ' A' ' 4' ' ' HYP . 34.9 pt -65.8 115.84 4.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -164.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.479 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 4.1 p-10 -159.4 11.1 0.13 Allowed 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.923 171.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -91.24 -177.28 4.83 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.816 -1.083 . . . . 0.0 108.527 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.435 ' HD2' ' HG2' ' A' ' 25' ' ' LYS . 14.5 mmmm -87.12 135.77 33.17 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.508 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 25.2 p -116.07 138.07 51.56 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.804 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -131.67 169.27 16.4 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -56.23 -47.02 79.31 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.448 0.468 . . . . 0.0 112.08 -177.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -102.41 12.02 37.15 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.091 0.472 . . . . 0.0 110.626 -173.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.26 99.86 9.23 Favored 'General case' 0 N--CA 1.432 -1.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.59 101.89 11.01 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-O 121.347 0.594 . . . . 0.0 110.146 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.14 -52.8 1.04 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.462 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 47.0 m -70.16 115.95 9.95 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -177.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 73.4 m -59.36 -28.47 66.89 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -177.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.4 t -72.6 -35.98 68.0 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.248 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? 59.84 18.32 7.29 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.853 0.861 . . . . 0.0 111.086 -172.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -88.34 112.75 23.22 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.3 m -114.18 151.8 32.16 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 120.849 0.356 . . . . 0.0 111.054 -177.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 p30 -108.9 -176.56 3.07 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.18 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.0 ptt180 -60.37 -12.06 8.3 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 125.678 1.591 . . . . 0.0 114.119 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -104.17 7.07 36.09 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.3 m120 64.99 26.66 12.71 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.455 1.102 . . . . 0.0 110.269 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HG2' ' HD2' ' A' ' 7' ' ' LYS . 91.6 mttt -103.83 153.43 20.75 Favored 'General case' 0 N--CA 1.42 -1.953 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.15 176.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.5 m -79.93 145.01 32.86 Favored 'General case' 0 C--N 1.284 -2.252 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.19 164.99 23.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.5 175.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.59 131.15 84.75 Favored Pre-proline 0 C--N 1.309 -1.178 0 O-C-N 123.752 0.657 . . . . 0.0 110.597 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.88 178.68 7.12 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.489 2.126 . . . . 0.0 110.26 176.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.91 -23.38 41.85 Favored 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.5 m -64.45 -34.69 78.78 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.592 176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.53 -148.61 18.71 Favored Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.601 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.2 60.82 0.6 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 -177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.001 0 C-N-CA 121.274 -0.489 . . . . 0.0 112.443 -178.655 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.6 t . . . . . 0 C--O 1.244 0.77 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.8 ttp180 -66.33 149.16 50.79 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.453 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.488 ' HA ' HD23 ' A' ' 4' ' ' HYP . 27.5 pt -39.24 124.95 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.59 0 C-N-CA 124.607 1.163 . . . . 0.0 113.9 -175.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.488 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -132.21 11.55 4.59 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 123.454 0.702 . . . . 0.0 109.293 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.677 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 15.5 mm100 -89.28 167.95 12.65 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.801 -178.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.527 ' O ' ' HE2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.51 148.18 22.9 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.638 174.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.4 p -137.83 133.52 34.05 Favored 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.245 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -137.32 177.16 8.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -71.58 -49.68 38.22 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.984 0.421 . . . . 0.0 110.493 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -88.04 -24.12 23.57 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.428 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.9 86.71 2.64 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -91.06 110.64 21.91 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.677 -176.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -112.72 -52.46 2.78 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.677 ' SG ' ' HB2' ' A' ' 6' ' ' GLN . 69.4 m -86.96 133.63 33.57 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.926 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -25.78 67.8 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.039 0.935 . . . . 0.0 112.138 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 p -78.16 -35.88 48.31 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-O 121.175 0.512 . . . . 0.0 112.046 -177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 62.03 18.78 10.24 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.19 0.996 . . . . 0.0 110.814 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -86.33 101.39 13.05 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.6 m -108.53 145.65 34.45 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.945 -173.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.0 p30 -93.0 -178.07 4.69 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.562 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -67.71 -2.65 7.33 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.502 0.721 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -106.34 5.04 29.25 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 120.774 0.321 . . . . 0.0 110.222 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 65.88 24.15 11.29 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.873 0.869 . . . . 0.0 111.156 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -107.2 154.4 21.28 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.3 m -73.89 149.32 41.56 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.8 m -123.05 175.92 5.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.091 174.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.51 HD12 ' HD2' ' A' ' 29' ' ' PRO . 48.0 tp -57.71 119.87 36.89 Favored Pre-proline 0 C--N 1.323 -0.563 0 O-C-N 124.175 0.922 . . . . 0.0 111.391 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.51 ' HD2' HD12 ' A' ' 28' ' ' LEU . 63.2 Cg_endo -74.26 171.27 18.37 Favored 'Trans proline' 0 C--O 1.251 1.153 0 C-N-CA 122.721 2.281 . . . . 0.0 110.691 177.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -69.02 -15.95 63.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.078 0.466 . . . . 0.0 110.178 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.7 m 81.46 112.11 0.06 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.369 1.467 . . . . 0.0 111.941 176.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.27 67.49 0.43 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.47 -65.32 0.89 Allowed Glycine 0 C--N 1.308 -1.021 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.437 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 C--O 1.244 0.807 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -42.91 122.98 2.58 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 124.635 1.174 . . . . 0.0 111.943 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.5 pt -65.56 158.11 4.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.942 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.409 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.4 t30 77.4 -2.07 2.64 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.404 1.482 . . . . 0.0 111.192 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -78.91 136.15 37.19 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 172.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -82.55 141.52 32.55 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 118.554 -1.258 . . . . 0.0 111.032 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.0 p -125.31 149.46 48.06 Favored 'General case' 0 C--N 1.293 -1.855 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.435 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 92.9 m-85 -125.97 177.07 6.55 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -58.16 -41.62 84.2 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -174.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -110.0 13.12 23.47 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.223 0.535 . . . . 0.0 110.634 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 7.7 mp -120.33 102.49 8.51 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.842 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -125.98 117.61 23.64 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.697 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -132.46 22.6 4.36 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 106.457 -1.682 . . . . 0.0 106.457 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.4 m -100.45 147.16 26.17 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.05 -1.432 . . . . 0.0 110.482 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.5 m -81.46 -37.89 27.26 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -80.64 -24.89 38.69 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.296 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 61.4 mtm-85 56.04 28.29 12.6 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.07 0.948 . . . . 0.0 110.943 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -109.66 125.35 52.51 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.515 -176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.1 m -117.88 139.19 51.47 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.8 p30 -89.43 -174.83 4.51 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 120.834 0.349 . . . . 0.0 110.907 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.4 ptt180 -62.86 -4.87 2.37 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.363 1.465 . . . . 0.0 114.033 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.96 16.3 15.12 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.157 -0.34 . . . . 0.0 110.552 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.8 19.14 11.31 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.204 0.526 . . . . 0.0 111.007 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -92.07 135.31 34.07 Favored 'General case' 0 N--CA 1.428 -1.567 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 54.0 t -70.93 134.16 47.0 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.8 m -119.65 150.28 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.425 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -77.33 143.45 69.03 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.224 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.425 ' HD2' HD12 ' A' ' 28' ' ' LEU . 40.3 Cg_exo -56.36 110.33 0.56 Allowed 'Trans proline' 0 C--O 1.243 0.728 0 C-N-CA 122.33 2.02 . . . . 0.0 110.397 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -83.54 -26.47 30.09 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 -175.236 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.3 m -81.48 -21.27 38.83 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-O 121.455 0.645 . . . . 0.0 109.678 -177.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.63 135.21 1.87 Allowed Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.704 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 122.96 2.29 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 119.937 -1.125 . . . . 0.0 112.775 177.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.388 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 177.816 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.915 0 CA-C-O 122.54 1.162 . . . . 0.0 108.675 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -103.04 123.35 46.47 Favored 'General case' 0 C--N 1.275 -2.654 0 CA-C-N 112.709 -2.042 . . . . 0.0 105.558 177.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -56.0 119.77 2.39 Favored 'Isoleucine or valine' 0 C--O 1.245 0.847 0 O-C-N 123.648 0.592 . . . . 0.0 111.112 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.609 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -138.6 10.37 2.69 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -97.59 162.34 13.34 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.504 -176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -84.38 132.68 34.56 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.684 0.615 . . . . 0.0 110.488 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -138.29 145.0 40.71 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-O 121.755 0.788 . . . . 0.0 110.661 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.67 -164.96 1.28 Allowed 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -72.33 -46.41 55.72 Favored 'General case' 0 N--CA 1.42 -1.931 0 CA-C-O 120.754 0.311 . . . . 0.0 111.157 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -105.28 -7.22 19.06 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 120.976 0.417 . . . . 0.0 112.098 -176.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mp -114.89 93.81 4.48 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -153.89 138.3 16.73 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -133.76 -0.15 3.18 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.812 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.0 m -70.11 131.59 44.52 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.219 -0.301 . . . . 0.0 110.533 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.8 m -58.63 -32.2 68.82 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 121.462 0.649 . . . . 0.0 110.032 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.25 -36.21 79.38 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.76 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.17 26.51 10.37 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.598 1.159 . . . . 0.0 111.745 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 59.1 tttp -126.34 132.19 51.64 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.1 m -119.96 142.8 48.43 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.203 0.314 . . . . 0.0 110.545 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -90.38 -179.19 5.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -58.47 -29.33 66.12 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -88.53 13.59 11.7 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.706 0.288 . . . . 0.0 111.292 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 m120 64.86 29.81 12.37 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -109.43 147.94 31.99 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.652 -0.819 . . . . 0.0 109.112 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.609 ' HB2' ' HA ' ' A' ' 4' ' ' HYP . 59.7 m -62.7 142.59 58.05 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 124.07 0.856 . . . . 0.0 110.848 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.7 m -136.9 168.78 21.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 50.0 mt -88.77 122.93 68.8 Favored Pre-proline 0 C--N 1.312 -1.037 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -81.65 -166.64 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.52 2.814 . . . . 0.0 110.236 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 mp0 -76.31 -33.19 59.04 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.9 p -77.75 -16.76 58.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.273 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.11 -147.16 23.4 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.335 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 115.89 54.1 0.36 Allowed Glycine 0 C--N 1.301 -1.389 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 C-N-CA 121.578 -0.344 . . . . 0.0 113.566 -176.391 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -57.79 141.34 49.21 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pp -82.22 152.65 4.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.879 -176.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.553 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 t30 82.87 -24.68 0.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.616 1.566 . . . . 0.0 112.372 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -60.96 145.02 52.03 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -77.45 139.46 39.66 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.5 p -119.95 133.81 55.44 Favored 'General case' 0 C--N 1.289 -2.049 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -125.33 143.03 51.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 121.254 0.549 . . . . 0.0 111.869 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.434 ' HG3' ' ND1' ' A' ' 11' ' ' HIS . 11.8 pt20 -61.85 -16.18 48.12 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.317 1.047 . . . . 0.0 113.797 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.434 ' ND1' ' HG3' ' A' ' 10' ' ' GLN . 76.1 m80 -112.5 13.72 20.16 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.023 -0.423 . . . . 0.0 111.938 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -121.82 165.19 16.25 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 177.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -115.0 30.66 7.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.649 0.738 . . . . 0.0 109.194 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -48.44 -52.53 21.69 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.019 1.328 . . . . 0.0 112.858 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 74.7 m -108.63 152.36 24.9 Favored 'General case' 0 C--N 1.278 -2.514 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.146 176.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -59.55 -45.63 91.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 t -108.37 -15.72 14.4 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.831 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 82.8 mtm180 49.35 51.01 17.13 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.505 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.45 100.82 4.61 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.7 m -96.55 130.43 43.73 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.02 -173.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.448 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.8 p30 -80.27 -175.87 5.32 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.465 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -67.51 -2.95 7.32 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -115.52 12.65 16.23 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.3 m120 63.66 23.57 13.58 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.944 0.878 . . . . 0.0 110.93 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' HD21 ' A' ' 21' ' ' ASN . 98.4 mttt -96.91 146.12 25.25 Favored 'General case' 0 N--CA 1.411 -2.375 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.129 174.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.553 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 27.3 t -84.71 143.52 29.13 Favored 'General case' 0 C--N 1.256 -3.488 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.448 -174.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 m -125.25 136.48 60.71 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.075 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -55.9 147.33 43.83 Favored Pre-proline 0 C--O 1.244 0.777 0 O-C-N 123.656 0.598 . . . . 0.0 112.169 -174.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -50.87 136.63 43.54 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.257 2.638 . . . . 0.0 111.349 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -70.25 -9.89 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 p -77.47 -30.3 53.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-O 121.326 0.584 . . . . 0.0 110.017 172.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.67 168.15 31.04 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.575 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.57 173.86 13.18 Favored Glycine 0 N--CA 1.427 -1.915 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.147 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.108 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 178.401 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.564 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 tpp180 -67.03 127.93 34.45 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 173.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.4 pt -59.35 149.22 6.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 O-C-N 123.951 0.782 . . . . 0.0 111.659 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.582 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 80.01 -9.28 1.43 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.813 1.245 . . . . 0.0 112.552 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -79.63 151.88 30.32 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 mmmp? -74.46 130.55 39.83 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.069 0.461 . . . . 0.0 112.098 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.452 ' HA ' HD23 ' A' ' 12' ' ' LEU . 26.4 p -114.54 159.04 20.85 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 175.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -146.0 163.48 35.06 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 -177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -75.44 -15.74 60.4 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.162 0.506 . . . . 0.0 112.216 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -101.56 12.13 37.78 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.691 0.757 . . . . 0.0 110.091 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 8' ' ' CYS . 33.9 tp -120.03 149.61 41.88 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 105.553 -2.017 . . . . 0.0 105.553 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.23 19.44 2.77 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.509 -1.276 . . . . 0.0 112.369 -174.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.564 ' HB3' ' HB2' ' A' ' 2' ' ' ARG . 7.9 m-20 -67.71 -17.07 64.44 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.0 m -85.76 110.36 19.29 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.5 m -53.33 -44.78 68.73 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.6 t -102.56 9.88 39.16 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.475 0.655 . . . . 0.0 110.139 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' ARG . 4.5 mpt_? 59.08 31.25 21.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.104 0.962 . . . . 0.0 111.63 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.45 120.14 25.09 Favored 'General case' 0 CA--C 1.501 -0.927 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.254 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.5 m -131.02 148.93 52.81 Favored 'General case' 0 C--N 1.275 -2.67 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.594 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -88.41 176.92 6.98 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -66.39 -15.14 63.07 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -95.89 6.19 49.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 120.734 0.302 . . . . 0.0 111.122 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 71.69 32.66 1.93 Allowed 'General case' 0 C--O 1.26 1.619 0 C-N-CA 123.877 0.871 . . . . 0.0 112.185 178.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.82 149.25 25.22 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 172.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.582 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 21.2 t -78.93 135.15 36.88 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -176.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 m -118.21 145.28 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 CA-C-O 120.958 0.408 . . . . 0.0 110.436 177.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.474 HD12 ' HD2' ' A' ' 29' ' ' PRO . 29.2 tp -67.82 127.28 93.35 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.921 -171.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.474 ' HD2' HD12 ' A' ' 28' ' ' LEU . 78.3 Cg_endo -82.83 175.87 8.24 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.773 2.315 . . . . 0.0 111.42 175.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -92.12 -48.26 6.81 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.154 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.7 m -59.94 -48.32 82.17 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -115.52 149.59 18.82 Favored Glycine 0 N--CA 1.434 -1.44 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.549 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.24 -27.78 5.18 Favored Glycine 0 C--N 1.306 -1.092 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.774 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 CA-C-O 121.505 0.503 . . . . 0.0 111.986 -178.018 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 122.309 1.052 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.491 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 17.6 tpp180 -100.01 139.19 36.04 Favored 'General case' 0 C--N 1.273 -2.755 0 CA-C-N 113.823 -1.535 . . . . 0.0 106.914 168.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.8 pt -63.29 147.88 11.77 Favored 'Isoleucine or valine' 0 C--O 1.246 0.909 0 O-C-N 123.267 0.354 . . . . 0.0 110.701 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 76.27 -5.32 2.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.004 1.322 . . . . 0.0 112.527 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -84.06 158.38 21.46 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -80.74 126.08 30.86 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 120.736 0.303 . . . . 0.0 110.46 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 p -131.12 138.59 49.58 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -129.95 175.77 8.6 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -64.16 -19.93 65.65 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -118.22 13.47 13.74 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.399 0.619 . . . . 0.0 110.045 175.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.4 mt -135.21 35.07 3.03 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.467 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 11.1 m-20 -79.44 87.59 5.06 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.802 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -87.78 -12.71 44.29 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.797 0.808 . . . . 0.0 109.814 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.491 ' SG ' ' HB3' ' A' ' 2' ' ' ARG . 29.7 m -81.16 118.22 22.37 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 173.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.6 m -63.86 -32.84 74.49 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -169.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.2 m -81.86 -7.94 59.64 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.592 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.467 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 77.6 mtp180 57.52 28.54 15.7 Favored 'General case' 0 C--N 1.358 0.936 0 C-N-CA 124.877 1.271 . . . . 0.0 111.413 -176.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.6 tttm -83.16 100.53 10.61 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -128.1 144.79 51.13 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.651 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -89.39 -179.1 5.76 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 120.964 0.412 . . . . 0.0 111.301 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -63.47 -18.07 63.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -93.58 5.24 52.27 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.134 0.492 . . . . 0.0 109.717 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 68.52 24.39 7.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.306 1.043 . . . . 0.0 110.882 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -97.11 135.83 38.52 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.3 t -68.05 135.98 53.1 Favored 'General case' 0 C--N 1.287 -2.145 0 O-C-N 123.559 0.537 . . . . 0.0 109.653 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.2 m -117.62 143.03 29.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 CA-C-O 120.601 0.239 . . . . 0.0 110.544 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.414 HD12 ' HD2' ' A' ' 29' ' ' PRO . 35.4 tp -67.48 125.51 91.27 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.845 -172.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.414 ' HD2' HD12 ' A' ' 28' ' ' LEU . 6.7 Cg_exo -69.11 107.87 1.83 Allowed 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.672 2.248 . . . . 0.0 108.72 170.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -15.62 62.2 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-O 121.252 0.549 . . . . 0.0 112.056 -174.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -112.51 9.52 19.56 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 122.037 0.922 . . . . 0.0 108.936 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -145.23 -133.54 2.61 Favored Glycine 0 N--CA 1.435 -1.37 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -157.89 152.14 23.34 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.489 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.034 -178.132 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' HG ' ' A' ' 28' ' ' LEU . 33.6 m . . . . . 0 N--CA 1.443 -0.812 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.4 HH21 ' CG ' ' A' ' 14' ' ' ASP . 4.1 tpp180 -62.11 136.28 57.88 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 173.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.1 pt -49.59 135.37 7.65 Favored 'Isoleucine or valine' 0 C--O 1.254 1.342 0 O-C-N 123.753 0.658 . . . . 0.0 111.941 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.598 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -136.8 -22.97 1.21 Allowed 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.979 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -76.09 164.65 25.91 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 27.6 mtpp -78.38 171.23 15.39 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.137 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -117.83 133.46 55.91 Favored 'General case' 0 C--N 1.285 -2.225 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -125.53 160.55 29.26 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -62.14 -25.57 67.82 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 123.489 0.716 . . . . 0.0 112.462 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -101.92 6.23 41.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.702 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.7 tp -97.65 95.16 7.4 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-O 121.236 0.541 . . . . 0.0 110.175 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -97.02 10.89 37.98 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.539 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' CG ' HH21 ' A' ' 2' ' ' ARG . 14.1 t70 -78.41 -23.79 46.55 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.448 1.118 . . . . 0.0 108.443 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.1 m -79.88 107.49 12.7 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 170.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.3 m -52.31 -47.09 66.14 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.716 0.635 . . . . 0.0 112.665 -169.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.7 m -98.85 4.83 47.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.771 -177.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 53.37 30.78 10.82 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.449 0.7 . . . . 0.0 110.358 -175.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -83.26 130.72 35.09 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.112 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 63.7 m -120.17 151.68 38.76 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.217 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HB2' ' A' ' 25' ' ' LYS . 39.5 p30 -99.89 -176.16 3.17 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 174.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -62.61 -11.92 19.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.9 12.03 29.29 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 121.888 -0.507 . . . . 0.0 110.745 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 66.28 25.13 10.56 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 122.136 0.969 . . . . 0.0 108.95 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 68.3 mttm -93.81 160.4 14.76 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.572 176.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.598 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 52.2 t -84.67 143.93 28.9 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.0 m -140.22 154.2 22.77 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 CA-C-O 120.97 0.414 . . . . 0.0 110.036 175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.436 ' HG ' ' HB2' ' A' ' 1' ' ' CYS . 7.8 mp -90.29 154.73 46.85 Favored Pre-proline 0 C--N 1.305 -1.365 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -74.06 179.95 5.26 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 122.291 1.994 . . . . 0.0 111.01 174.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.56 -32.16 73.08 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 122.79 0.436 . . . . 0.0 111.412 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.9 p -83.58 2.73 35.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 73.59 -113.29 4.17 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.366 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.14 170.9 29.69 Favored Glycine 0 N--CA 1.438 -1.196 0 N-CA-C 111.366 -0.694 . . . . 0.0 111.366 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.304 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 179.335 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.955 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -46.87 123.59 5.34 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.552 1.141 . . . . 0.0 110.612 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.431 ' HA ' HD23 ' A' ' 4' ' ' HYP . 33.6 pt -58.25 151.43 4.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -174.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.431 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -108.55 1.65 21.59 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.238 1.018 . . . . 0.0 109.397 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -83.83 168.34 16.22 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.309 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -86.83 132.37 33.85 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.663 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 27.7 p -115.0 141.55 47.84 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -148.08 157.26 43.41 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.57 -35.64 80.14 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.187 0.518 . . . . 0.0 111.241 -176.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.0 p-80 -95.89 11.28 34.37 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.882 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.8 tp -114.4 111.97 22.28 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 121.663 0.744 . . . . 0.0 109.086 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -94.86 15.72 17.84 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.704 -174.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -60.79 -48.79 80.22 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.721 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.0 m -90.24 127.4 36.13 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.78 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.4 m -50.55 -42.2 55.08 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 125.832 1.653 . . . . 0.0 112.687 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.492 ' HB3' ' HD3' ' A' ' 29' ' ' PRO . 29.9 p -83.66 -23.13 31.91 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? 61.61 16.39 7.66 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.18 0.592 . . . . 0.0 110.86 -172.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 13.7 mmmm -90.74 150.71 21.51 Favored 'General case' 0 CA--C 1.48 -1.73 0 O-C-N 122.086 -0.384 . . . . 0.0 110.98 -177.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 90.4 m -127.09 142.57 51.49 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-N 114.556 -1.202 . . . . 0.0 112.277 -173.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.453 HD21 ' HB2' ' A' ' 25' ' ' LYS . 33.5 p30 -104.31 -177.66 3.43 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.324 174.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -62.64 -15.22 50.93 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -100.18 5.59 44.77 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 121.998 -0.439 . . . . 0.0 111.487 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 t30 71.64 17.04 5.66 Favored 'General case' 0 N--CA 1.505 2.317 0 CA-C-O 123.394 1.568 . . . . 0.0 108.9 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.9 mttm -94.53 158.32 15.59 Favored 'General case' 0 N--CA 1.415 -2.213 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.297 176.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.663 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 60.0 m -74.51 150.88 39.62 Favored 'General case' 0 C--N 1.281 -2.407 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.123 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 19' ' ' LYS . 3.0 m -130.57 116.96 37.26 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.348 0.594 . . . . 0.0 109.477 170.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 24.6 tp -90.29 142.68 28.61 Favored Pre-proline 0 C--N 1.289 -2.031 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 17' ' ' SER . 85.0 Cg_exo -51.77 154.61 9.3 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 123.099 2.532 . . . . 0.0 113.028 177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.46 -22.93 35.0 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.4 p -77.85 87.89 4.06 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 123.95 -97.25 0.55 Allowed Glycine 0 N--CA 1.423 -2.223 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.99 -13.83 63.62 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 121.212 -0.518 . . . . 0.0 113.602 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.18 0 C-N-CA 121.37 -0.443 . . . . 0.0 112.747 -176.767 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.435 -1.222 0 CA-C-O 121.224 0.535 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -69.68 135.39 49.8 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.507 HG13 ' HG2' ' A' ' 6' ' ' GLN . 30.0 pt -53.89 138.18 13.8 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -176.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -87.88 7.88 28.69 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -175.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.507 ' HG2' HG13 ' A' ' 3' ' ' ILE . 84.3 mm-40 -83.4 152.07 25.2 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 120.647 0.261 . . . . 0.0 110.418 177.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.42 122.51 27.59 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.392 178.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 26' ' ' CYS . 25.3 p -129.15 155.75 45.0 Favored 'General case' 0 C--N 1.285 -2.199 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -122.37 -174.31 2.88 Favored 'General case' 0 C--N 1.293 -1.863 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.298 -176.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -69.41 -40.02 77.58 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -175.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -105.38 -21.55 13.21 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 119.831 -0.748 . . . . 0.0 111.302 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.9 mp -114.09 103.6 11.29 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.068 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' OD1' ' HA ' ' A' ' 18' ' ' ARG . 1.6 p30 -148.93 163.0 38.74 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -133.1 31.44 3.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.2 m -95.92 139.06 32.67 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.883 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 m -60.3 -37.97 82.19 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 121.549 0.69 . . . . 0.0 110.651 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -85.97 -10.32 55.33 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.72 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.466 ' HA ' ' OD1' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 62.07 17.86 9.47 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.583 1.153 . . . . 0.0 110.949 -174.733 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -105.18 140.94 37.58 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 121.774 0.797 . . . . 0.0 112.233 -173.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.7 m -131.2 147.87 52.64 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 176.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -84.52 -175.27 5.71 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 118.476 0.58 . . . . 0.0 110.001 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -68.63 -8.23 40.26 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -103.46 7.16 37.93 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m120 63.58 32.15 14.21 Favored 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 124.024 0.929 . . . . 0.0 112.295 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -92.33 138.48 31.48 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 174.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.459 ' HA ' ' SG ' ' A' ' 8' ' ' CYS . 42.5 t -62.76 113.98 3.35 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 124.024 0.827 . . . . 0.0 110.712 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . 0.255 24.8 m -105.24 102.69 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 CA-C-O 122.842 1.306 . . . . 0.0 112.374 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.21 155.77 91.51 Favored Pre-proline 0 C--N 1.3 -1.55 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.674 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -75.47 174.09 13.39 Favored 'Trans proline' 0 N--CA 1.439 -1.692 0 C-N-CA 120.876 1.051 . . . . 0.0 109.938 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -66.93 -29.91 69.91 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.672 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -63.72 -25.09 68.04 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.062 176.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.37 -137.21 34.96 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 128.99 -164.94 21.94 Favored Glycine 0 N--CA 1.435 -1.419 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.239 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 177.4 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.3 ttm-85 -51.6 124.65 12.71 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 119.457 1.026 . . . . 0.0 112.144 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt -65.33 155.52 6.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.0 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.0 t30 83.65 -15.18 0.64 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 126.483 1.913 . . . . 0.0 111.737 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -69.55 153.78 42.97 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -77.92 159.31 28.95 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.492 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 18.0 p -123.26 150.98 42.82 Favored 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 112.943 -1.935 . . . . 0.0 106.009 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.4 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 90.1 m-85 -126.48 174.05 8.93 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.02 -44.88 91.77 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 123.833 0.708 . . . . 0.0 111.463 -177.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -118.43 -30.68 5.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.808 175.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 6.9 mp -77.78 92.37 4.19 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.873 0.844 . . . . 0.0 111.521 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -127.42 118.2 23.62 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.082 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -123.79 12.98 9.21 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-O 122.861 1.315 . . . . 0.0 107.931 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m -83.86 111.1 18.91 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 m -57.38 -26.14 60.59 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 123.477 0.711 . . . . 0.0 111.786 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 p -71.45 -27.87 63.56 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.427 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 54.8 21.84 3.83 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 125.077 1.351 . . . . 0.0 113.361 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -119.88 125.22 47.97 Favored 'General case' 0 N--CA 1.415 -2.205 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.407 ' SG ' ' HA ' ' A' ' 24' ' ' ASN . 42.6 t -130.67 142.9 50.44 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.9 p30 -90.01 178.2 6.26 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 120.975 0.417 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -64.26 -18.67 64.78 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -88.62 0.97 55.84 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.675 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.407 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.9 OUTLIER 73.74 27.67 1.7 Allowed 'General case' 0 C--O 1.246 0.894 0 C-N-CA 124.15 0.98 . . . . 0.0 111.454 178.098 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -106.6 129.72 54.48 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 71.1 m -70.38 135.35 48.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.7 m -123.02 150.98 27.09 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.357 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.0 tp -90.01 141.32 27.9 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 -176.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.55 175.64 8.47 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 121.775 1.65 . . . . 0.0 112.627 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -28.93 70.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.476 -178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -78.28 -3.08 41.1 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.855 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.33 -145.68 29.58 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.795 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 146.55 140.26 3.43 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.117 -0.793 . . . . 0.0 111.117 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.538 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.437 -1.125 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -61.46 130.89 48.2 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 117.71 0.232 . . . . 0.0 110.384 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.49 ' H ' HD13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -53.8 140.67 10.04 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 O-C-N 124.043 0.839 . . . . 0.0 113.096 -178.35 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -127.05 9.45 6.82 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.436 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 12.3 mm-40 -99.09 175.59 5.85 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.985 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.25 150.17 21.81 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.281 -178.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.2 p -147.16 161.22 41.34 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.488 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 91.8 m-85 -134.06 -170.86 2.6 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -70.04 -49.4 51.66 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -103.11 -4.04 25.04 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.923 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HB2' ' HB2' ' A' ' 9' ' ' PHE . 79.9 mt -99.92 94.03 6.08 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.408 ' HB3' ' HG2' ' A' ' 18' ' ' ARG . 11.5 m-20 -95.36 80.14 3.5 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.515 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.57 -49.21 56.39 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.68 0.753 . . . . 0.0 109.171 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -80.06 141.94 35.38 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.125 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.19 -21.84 62.1 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 124.183 0.993 . . . . 0.0 110.513 -175.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 40.7 p -70.24 -28.08 64.97 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.308 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HG2' ' HB3' ' A' ' 13' ' ' ASP . 76.7 mtp180 57.0 26.88 12.43 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.489 1.116 . . . . 0.0 111.49 -177.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -121.08 120.58 35.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.039 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.4 m -109.69 151.43 26.9 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.16 -178.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -103.16 -173.75 2.39 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.8 ptp180 -68.22 -11.33 59.12 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -94.06 1.67 56.15 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 68.13 22.44 8.31 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 122.403 1.097 . . . . 0.0 110.368 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -106.7 163.74 12.66 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.282 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.7 m -79.86 148.57 31.28 Favored 'General case' 0 C--N 1.284 -2.264 0 O-C-N 123.433 0.458 . . . . 0.0 110.779 -177.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.1 m -126.4 170.52 16.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.324 173.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.3 tp -77.87 131.29 70.65 Favored Pre-proline 0 N--CA 1.434 -1.266 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.53 159.67 28.73 Favored 'Trans proline' 0 N--CA 1.444 -1.416 0 C-N-CA 122.154 1.903 . . . . 0.0 110.784 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -71.87 -16.98 62.15 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.738 0.78 . . . . 0.0 110.066 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.6 p -81.22 -0.32 40.07 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.81 -90.49 1.66 Allowed Glycine 0 N--CA 1.431 -1.667 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 88.73 -174.91 43.29 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.485 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.575 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.853 0.835 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.18 140.35 30.23 Favored 'General case' 0 C--N 1.264 -3.123 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.559 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.467 ' HA ' HD23 ' A' ' 4' ' ' HYP . 12.8 pt -72.53 133.07 32.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.467 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.96 0.19 10.74 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.48 141.97 51.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.75 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.517 ' N ' ' HE3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -67.86 145.66 54.41 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 167.661 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.1 p -115.94 145.29 43.05 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 117.443 -1.703 . . . . 0.0 113.382 -176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -137.39 133.36 34.7 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -55.26 -33.7 63.4 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -168.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -99.96 5.89 45.19 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.6 mt -91.34 139.73 30.45 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.533 -0.867 . . . . 0.0 111.444 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -82.71 -8.6 59.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.723 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -52.17 -39.44 60.06 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.329 1.052 . . . . 0.0 109.484 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 59.1 m -92.65 99.54 12.22 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.402 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.3 m -58.4 -37.4 75.24 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.49 0.662 . . . . 0.0 109.916 176.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 m -75.92 -23.72 55.49 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.8 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 53.14 23.23 2.95 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.292 1.037 . . . . 0.0 113.371 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.43 140.44 49.14 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -175.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -128.23 151.97 48.64 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.869 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -94.94 174.95 6.84 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -64.03 -12.25 36.76 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -99.86 9.95 42.14 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 122.439 -0.163 . . . . 0.0 111.288 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 t30 72.3 17.22 4.93 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 124.403 1.081 . . . . 0.0 111.269 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -93.38 146.88 23.41 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.1 t -87.97 112.52 22.66 Favored 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.3 m -102.2 162.96 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 121.392 0.615 . . . . 0.0 112.29 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.03 139.32 79.58 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.56 156.32 42.72 Favored 'Trans proline' 0 C--O 1.24 0.577 0 C-N-CA 122.304 2.003 . . . . 0.0 110.539 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.09 -20.7 62.32 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.702 0.287 . . . . 0.0 111.385 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -88.4 -9.44 52.61 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.924 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 116.61 -143.4 18.04 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.815 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.42 -148.85 19.2 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.453 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.49 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.291 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' HD3' ' A' ' 29' ' ' PRO . 18.3 t . . . . . 0 C--O 1.247 0.957 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -59.52 178.43 0.15 Allowed 'General case' 0 C--O 1.251 1.16 0 CA-C-O 122.312 1.053 . . . . 0.0 111.566 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.462 HG13 ' HG2' ' A' ' 6' ' ' GLN . 15.6 pt -76.2 133.02 31.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.454 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -125.86 3.9 7.36 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 174.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.462 ' HG2' HG13 ' A' ' 3' ' ' ILE . 15.8 mm100 -64.42 142.18 58.51 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -93.03 124.14 36.79 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.28 151.08 52.0 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -128.75 -165.38 1.5 Allowed 'General case' 0 C--N 1.285 -2.202 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -73.74 -49.74 24.08 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.694 -0.802 . . . . 0.0 111.615 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -90.68 -29.91 17.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.251 0.548 . . . . 0.0 110.345 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.27 82.43 5.46 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.49 ' CG ' ' HG2' ' A' ' 18' ' ' ARG . 13.2 t70 -105.79 137.13 44.19 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.57 -178.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -128.91 -0.35 5.32 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.488 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 64.0 m -95.48 177.23 5.89 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.472 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -80.38 -33.38 37.21 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.819 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.4 m -134.89 24.46 3.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.607 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HG2' ' CG ' ' A' ' 13' ' ' ASP . 58.9 mtm180 50.12 24.57 1.45 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 124.07 0.948 . . . . 0.0 112.808 -175.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -85.2 107.58 17.32 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.914 0.864 . . . . 0.0 111.821 -177.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 m -117.92 136.48 53.45 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 113.574 -1.648 . . . . 0.0 108.819 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -81.05 -177.73 6.57 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 120.757 0.313 . . . . 0.0 110.947 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.46 ' H ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -56.31 -21.0 21.38 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 179.189 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -101.39 7.61 42.57 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.913 -0.492 . . . . 0.0 110.456 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.0 m120 66.23 25.67 10.55 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 123.943 0.897 . . . . 0.0 112.786 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -90.38 142.3 27.87 Favored 'General case' 0 N--CA 1.422 -1.828 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.556 172.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 18.4 t -67.07 125.46 26.07 Favored 'General case' 0 C--N 1.286 -2.155 0 O-C-N 124.654 1.221 . . . . 0.0 109.317 178.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.9 m -115.03 176.08 2.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-O 120.997 0.427 . . . . 0.0 111.008 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.61 148.7 87.95 Favored Pre-proline 0 C--N 1.303 -1.432 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.029 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' A' ' 1' ' ' CYS . 61.0 Cg_endo -74.42 172.26 16.47 Favored 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 122.656 2.238 . . . . 0.0 112.241 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -103.81 -26.04 12.86 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.646 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 m -85.18 -48.21 9.36 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.483 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -93.74 -178.41 39.41 Favored Glycine 0 C--O 1.244 0.725 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.915 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.62 -69.59 0.98 Allowed Glycine 0 C--O 1.243 0.688 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.511 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.258 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -58.97 160.98 5.37 Favored 'General case' 0 C--O 1.249 1.028 0 C-N-CA 123.061 0.544 . . . . 0.0 111.069 175.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.3 pt -77.45 149.43 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.654 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -116.37 -0.86 12.43 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.738 -0.601 . . . . 0.0 111.995 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -79.06 147.45 32.8 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.812 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.462 ' HE3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -88.9 149.11 23.49 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 176.617 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.3 p -145.1 141.5 28.87 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -119.46 172.05 7.91 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -54.23 -41.51 68.8 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -105.78 3.58 28.97 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.446 0.641 . . . . 0.0 110.798 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.4 mt -124.11 75.01 1.34 Allowed 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.082 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.407 ' CG ' ' HE ' ' A' ' 18' ' ' ARG . 8.2 m-20 -100.24 113.84 26.83 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.008 -178.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -113.1 -10.37 13.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.584 0.706 . . . . 0.0 110.161 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.4 m -71.9 139.46 48.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -54.18 -46.21 72.31 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.951 0.9 . . . . 0.0 111.711 -175.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t -101.33 13.69 34.3 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.407 ' HE ' ' CG ' ' A' ' 13' ' ' ASP . 83.3 mtp180 51.65 30.89 7.13 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.345 1.058 . . . . 0.0 112.023 -176.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -94.01 113.71 25.75 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.5 -172.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -125.11 136.55 53.75 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -85.37 -171.75 3.78 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.989 0.423 . . . . 0.0 111.788 -178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -66.83 -10.1 44.45 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.466 0.706 . . . . 0.0 112.785 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -108.15 11.03 27.84 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.48 25.18 15.0 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.536 0.735 . . . . 0.0 111.445 -177.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -94.71 145.69 24.68 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 12.2 t -71.5 135.79 47.28 Favored 'General case' 0 C--N 1.283 -2.29 0 O-C-N 124.572 1.17 . . . . 0.0 108.417 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.1 m -129.72 137.06 57.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 121.385 0.612 . . . . 0.0 111.523 178.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.457 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.3 tp -73.07 128.11 88.32 Favored Pre-proline 0 C--N 1.305 -1.368 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 176.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.457 ' HD2' HD12 ' A' ' 28' ' ' LEU . 18.8 Cg_endo -58.87 161.23 15.87 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.562 2.175 . . . . 0.0 111.823 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -70.42 -9.22 55.81 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.859 -175.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.3 p -69.78 -29.23 66.51 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.241 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.18 -151.69 20.86 Favored Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.544 -1.023 . . . . 0.0 110.544 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.5 30.54 Favored Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.889 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.986 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.375 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.516 ' SG ' ' HA ' ' A' ' 31' ' ' THR . 63.1 m . . . . . 0 N--CA 1.437 -1.121 0 CA-C-O 120.645 0.259 . . . . 0.0 110.77 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -64.19 152.31 41.08 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.902 0.881 . . . . 0.0 110.933 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 31.5 pt -65.9 152.36 9.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.381 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 73.41 9.65 5.08 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.928 0.891 . . . . 0.0 111.7 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -72.93 158.58 35.21 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.819 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -90.0 113.95 25.71 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.4 p -132.93 146.74 52.06 Favored 'General case' 0 C--N 1.284 -2.244 0 CA-C-O 121.673 0.749 . . . . 0.0 110.558 -178.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.08 -173.53 2.92 Favored 'General case' 0 C--N 1.282 -2.34 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -66.51 -49.77 65.43 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.283 0.564 . . . . 0.0 110.285 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -85.36 -27.17 26.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 110.315 -178.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.2 mp -98.67 79.03 2.4 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.005 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 8.7 p-10 -93.47 126.38 38.59 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -117.77 3.27 12.28 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.403 -176.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 60.1 m -130.83 149.75 52.32 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 121.792 -0.567 . . . . 0.0 110.862 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -51.79 -46.49 64.21 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.145 0.978 . . . . 0.0 112.4 -178.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -84.42 -3.55 58.4 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.986 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.44 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 74.6 mtt180 51.32 29.08 4.74 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.261 1.025 . . . . 0.0 112.416 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HE2' HG23 ' A' ' 27' ' ' VAL . 19.4 ptmt -94.77 126.54 40.15 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-O 122.205 1.002 . . . . 0.0 110.907 -176.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -127.96 141.79 51.43 Favored 'General case' 0 C--N 1.257 -3.433 0 CA-C-N 113.68 -1.6 . . . . 0.0 108.237 -179.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -82.51 -176.51 6.27 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -65.95 -11.24 46.03 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.12 4.09 31.02 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 122.31 -0.244 . . . . 0.0 110.941 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m120 76.26 22.3 1.34 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.683 0.793 . . . . 0.0 112.495 -178.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -96.79 131.37 43.58 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.4 t -62.71 131.19 48.11 Favored 'General case' 0 C--N 1.289 -2.04 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.707 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.456 HG23 ' HE2' ' A' ' 19' ' ' LYS . 1.8 m -102.34 167.13 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.69 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.311 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.415 ' H ' HD12 ' A' ' 28' ' ' LEU . 5.1 mp -58.52 114.28 8.48 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -169.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.91 162.89 38.27 Favored 'Trans proline' 0 C--O 1.243 0.77 0 C-N-CA 123.351 2.701 . . . . 0.0 112.541 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.25 -30.98 71.49 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.86 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.516 ' HA ' ' SG ' ' A' ' 1' ' ' CYS . 31.1 m 74.96 107.31 0.07 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.199 1.399 . . . . 0.0 112.599 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.12 66.06 0.42 Allowed Glycine 0 N--CA 1.438 -1.175 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.11 -69.51 3.28 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.177 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 178.623 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.441 -0.913 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -58.96 133.4 56.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 118.156 0.434 . . . . 0.0 109.98 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.501 ' HA ' HD23 ' A' ' 4' ' ' HYP . 32.4 pt -45.9 134.97 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -173.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.501 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -137.66 13.41 2.95 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 122.419 1.104 . . . . 0.0 109.328 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -90.03 140.8 29.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -72.0 141.42 49.36 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 123.282 0.364 . . . . 0.0 111.409 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.5 p -118.92 163.87 16.29 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.526 ' HB2' ' HB3' ' A' ' 12' ' ' LEU . 50.0 m-85 -134.96 158.58 43.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.48 -26.83 68.74 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.554 0.692 . . . . 0.0 110.246 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -110.86 16.17 21.43 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.334 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.526 ' HB3' ' HB2' ' A' ' 9' ' ' PHE . 37.6 tp -142.27 104.84 4.5 Favored 'General case' 0 N--CA 1.426 -1.632 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.727 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -109.07 117.26 33.72 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.625 0.726 . . . . 0.0 110.153 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -132.68 27.96 4.3 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.66 163.65 13.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 113.885 -1.507 . . . . 0.0 111.998 -173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.5 m -83.99 -46.26 12.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.617 176.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 m -96.47 -3.96 42.45 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.761 -174.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 54.87 21.34 3.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -107.2 141.77 37.96 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.56 -0.856 . . . . 0.0 111.067 -175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.7 m -111.87 152.09 28.35 Favored 'General case' 0 C--N 1.283 -2.32 0 CA-C-N 114.893 -1.049 . . . . 0.0 108.847 176.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -94.41 -179.63 4.98 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 174.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -67.59 -7.25 24.79 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 123.026 0.53 . . . . 0.0 112.226 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -102.71 5.17 38.81 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 122.587 0.355 . . . . 0.0 110.18 -179.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.3 t30 70.5 20.12 6.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 123.21 1.481 . . . . 0.0 110.622 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -100.02 153.24 19.36 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.612 -1.177 . . . . 0.0 108.133 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.78 129.08 36.23 Favored 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.462 ' HA ' ' HB2' ' A' ' 4' ' ' HYP . 22.6 m -130.83 149.99 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.656 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.5 tp -88.8 124.25 65.88 Favored Pre-proline 0 C--N 1.306 -1.307 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 172.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -74.71 -171.55 0.98 Allowed 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 122.029 1.819 . . . . 0.0 111.638 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -66.05 -23.98 66.64 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.246 0.546 . . . . 0.0 110.925 179.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.3 p -84.69 102.55 13.06 Favored 'General case' 0 N--CA 1.421 -1.904 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 145.5 147.68 4.66 Favored Glycine 0 N--CA 1.431 -1.697 0 N-CA-C 110.214 -1.154 . . . . 0.0 110.214 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.89 -38.27 6.54 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.938 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.787 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.521 ' HD2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.73 166.46 13.05 Favored 'General case' 0 C--O 1.249 1.029 0 C-N-CA 120.824 -0.351 . . . . 0.0 110.435 173.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.8 pt -69.71 156.86 6.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.574 -178.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -87.7 1.09 54.7 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 121.822 -0.549 . . . . 0.0 111.298 -178.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.517 ' HG3' ' HB3' ' A' ' 2' ' ' ARG . 16.1 mm100 -75.95 152.97 36.94 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.053 0.454 . . . . 0.0 110.876 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -94.92 116.81 29.18 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 171.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.7 p -118.45 160.99 20.74 Favored 'General case' 0 C--N 1.275 -2.653 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.01 -176.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -134.52 155.47 50.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -63.77 -27.7 69.37 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.396 0.617 . . . . 0.0 111.764 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -98.31 16.25 22.08 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.649 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 47.2 tp -136.45 108.25 7.07 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-O 120.917 0.389 . . . . 0.0 110.092 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -82.61 73.89 9.62 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.676 1.227 . . . . 0.0 111.512 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.521 ' O ' ' HD2' ' A' ' 2' ' ' ARG . 33.8 t70 -95.39 -29.07 14.63 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 174.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 52.1 m -109.92 135.47 50.73 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.9 m -50.45 -47.41 56.85 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -94.32 2.58 55.83 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.882 -173.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 55.0 30.32 13.94 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.556 0.693 . . . . 0.0 110.974 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -84.92 116.12 23.17 Favored 'General case' 0 CA--C 1.487 -1.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.457 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 24' ' ' ASN . 63.4 m -129.36 145.61 51.37 Favored 'General case' 0 C--N 1.277 -2.562 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.167 -177.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.402 HD21 ' HB2' ' A' ' 25' ' ' LYS . 34.2 p30 -83.51 -174.48 5.31 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 178.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -63.01 -16.42 59.75 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -102.61 12.17 36.75 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 20' ' ' CYS 0.306 3.3 p-10 50.46 36.91 14.4 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.894 1.678 . . . . 0.0 112.066 -175.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB2' HD21 ' A' ' 21' ' ' ASN . 68.8 mttm -91.3 153.97 19.57 Favored 'General case' 0 N--CA 1.424 -1.754 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.4 t -71.86 130.97 42.34 Favored 'General case' 0 C--N 1.286 -2.175 0 O-C-N 123.855 0.722 . . . . 0.0 112.01 -172.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.4 m -124.5 113.98 38.75 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.812 0.815 . . . . 0.0 110.262 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD12 ' HD2' ' A' ' 29' ' ' PRO . 26.4 tp -71.26 129.88 88.53 Favored Pre-proline 0 C--N 1.31 -1.139 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.352 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.478 ' HD2' HD12 ' A' ' 28' ' ' LEU . 10.5 Cg_endo -53.46 110.08 0.44 Allowed 'Trans proline' 0 C--N 1.367 1.512 0 C-N-CA 123.38 2.72 . . . . 0.0 112.218 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 60.2 18.22 7.66 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.73 1.212 . . . . 0.0 112.289 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 m 58.37 38.39 25.81 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-O 122.124 0.964 . . . . 0.0 109.542 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -151.06 94.85 0.15 Allowed Glycine 0 N--CA 1.435 -1.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.76 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.3 154.17 19.68 Favored Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.38 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 178.405 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.85 149.2 44.9 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.417 ' HA ' HD23 ' A' ' 4' ' ' HYP . 43.4 pt -66.47 148.47 12.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.936 -177.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.417 HD23 ' HA ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.7 m-20 -140.02 7.73 2.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.958 1.303 . . . . 0.0 109.732 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -81.84 150.97 27.56 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -89.96 167.51 12.74 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.588 -178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.9 p -154.21 147.77 25.17 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.203 -176.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -135.29 175.63 9.41 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.1 -43.11 99.39 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.3 0.571 . . . . 0.0 109.471 177.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.64 -1.99 58.32 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.907 -177.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.37 104.23 7.14 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 122.232 -0.292 . . . . 0.0 111.304 -177.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -101.27 91.33 4.46 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.43 0.633 . . . . 0.0 111.212 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -97.26 -13.47 21.97 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.395 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 26.6 m -76.9 141.03 40.71 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.361 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.5 m -51.76 -46.5 64.14 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.891 1.276 . . . . 0.0 112.108 -177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 t -112.42 20.62 16.51 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 55.91 17.76 2.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.532 1.133 . . . . 0.0 113.751 -177.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG2' HG23 ' A' ' 27' ' ' VAL . 22.1 ttmm -85.19 115.51 23.02 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.1 t -125.64 138.04 53.9 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -93.33 176.76 6.27 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.498 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 22' ' ' ARG . 19.8 ptt180 -69.81 -2.88 13.37 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.864 0.866 . . . . 0.0 112.366 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -99.33 6.19 46.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 64.39 34.77 10.16 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.957 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.627 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -132.74 144.39 50.25 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 25' ' ' LYS . 85.5 m -64.69 131.46 46.95 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 19' ' ' LYS . 3.7 m -114.71 135.75 53.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 175.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.7 tp -89.99 127.04 55.25 Favored Pre-proline 0 C--N 1.294 -1.816 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.565 -172.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.28 164.06 33.55 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 121.88 1.72 . . . . 0.0 109.772 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -73.73 -18.76 60.95 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 121.359 0.599 . . . . 0.0 111.559 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.4 m -94.41 6.38 48.92 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 121.659 0.742 . . . . 0.0 109.531 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -111.89 168.67 12.82 Favored Glycine 0 CA--C 1.505 -0.586 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.646 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.99 167.49 13.91 Favored Glycine 0 C--N 1.304 -1.203 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.588 0 N-CA-C 111.906 -0.478 . . . . 0.0 111.906 179.673 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 85.9 m . . . . . 0 C--O 1.244 0.793 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -66.15 168.77 7.97 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.862 173.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.7 pt -82.58 147.78 5.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.61 -177.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.426 ' HA ' ' O ' ' A' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -114.55 -7.19 12.81 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.986 -177.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -89.5 155.35 19.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -83.51 141.07 31.89 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.1 p -127.61 159.9 33.24 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -132.63 170.44 15.2 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.14 -38.11 72.25 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 121.029 0.443 . . . . 0.0 111.364 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -96.81 1.68 50.99 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.96 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.75 88.98 2.81 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 18' ' ' ARG . 26.2 m-20 -110.86 119.9 40.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.373 -176.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -133.49 -4.26 2.96 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.513 0.673 . . . . 0.0 111.633 170.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.5 m -79.04 145.11 34.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 174.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.82 -46.16 67.61 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.649 0.738 . . . . 0.0 111.961 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -83.84 -17.26 41.55 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.611 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.431 ' HG3' ' HB3' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 59.6 22.09 10.73 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.626 0.77 . . . . 0.0 110.713 -174.504 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.69 141.81 33.05 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 113.558 0.948 . . . . 0.0 113.558 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.4 m -130.61 138.3 50.05 Favored 'General case' 0 C--N 1.284 -2.279 0 CA-C-N 113.068 -1.878 . . . . 0.0 109.014 -178.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.467 HD22 HG13 ' A' ' 27' ' ' VAL . 9.4 p30 -98.24 -176.0 3.28 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.281 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -56.45 -28.52 59.81 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -178.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -81.49 2.0 30.83 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.072 0.463 . . . . 0.0 110.995 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 69.61 16.56 8.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.986 1.314 . . . . 0.0 110.634 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -97.68 159.55 14.86 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.032 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 4' ' ' HYP . 49.1 t -72.34 145.04 48.05 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 124.031 0.832 . . . . 0.0 111.154 -175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.467 HG13 HD22 ' A' ' 21' ' ' ASN . 11.4 m -129.29 123.77 58.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 121.507 0.67 . . . . 0.0 110.326 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.97 154.91 84.85 Favored Pre-proline 0 C--N 1.308 -1.227 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.041 -174.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -70.43 164.74 34.1 Favored 'Trans proline' 0 C--O 1.249 1.059 0 C-N-CA 122.496 2.131 . . . . 0.0 110.476 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -68.29 -35.99 78.67 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 m -72.13 -39.56 68.72 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.975 0.417 . . . . 0.0 110.163 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.81 -154.8 34.44 Favored Glycine 0 C--O 1.244 0.774 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 142.53 29.79 0.13 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.419 -0.896 . . . . 0.0 113.729 177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.782 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.802 -179.931 . . . . . . . . 0 0 . 1 stop_ save_