data_2l2r_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 2l2r _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 120.448 0.166 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -64.2 -64.33 0.91 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.281 0.563 . . . . 0.0 110.943 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.16 -34.68 66.4 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.737 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -68.04 -47.46 68.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.427 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -71.19 -26.53 63.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.108 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.2 mtm -69.04 -48.62 62.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.085 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -68.2 -35.67 78.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.333 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -69.34 -27.07 65.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -118.48 49.22 1.31 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.902 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 . . . . . 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.657 -179.805 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.224 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.26 -39.45 43.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.023 0.44 . . . . 0.0 111.198 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -50.85 -48.16 60.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.002 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.74 -35.73 71.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -75.13 -43.73 51.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.247 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 73.5 t -64.77 -40.81 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-O 120.808 0.337 . . . . 0.0 111.024 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 t -57.59 -45.64 85.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.946 0.403 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.48 -49.18 19.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.431 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 44.0 t -55.19 -45.29 75.81 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.485 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -72.58 -63.81 1.08 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.839 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.7 t -55.06 -35.89 65.0 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.099 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -65.53 -47.16 76.87 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.399 0.437 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.79 -26.66 62.51 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.04 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.5 mtm -71.07 -44.76 65.07 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -36.4 82.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.489 0.661 . . . . 0.0 111.073 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -72.14 -28.58 63.34 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -117.31 49.02 1.24 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.789 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 O-C-N 123.44 0.462 . . . . 0.0 110.523 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.526 0.047 0 CA-C-O 120.331 0.11 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.0 t -55.28 -42.51 66.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 O-C-N 123.597 0.561 . . . . 0.0 110.611 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.16 -48.99 61.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.776 0.322 . . . . 0.0 110.693 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.57 -34.4 67.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.847 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.67 -43.92 45.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.75 -40.96 89.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.165 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.23 -38.44 58.02 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 121.02 0.438 . . . . 0.0 110.849 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.38 -52.37 10.93 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.599 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -54.63 -54.66 38.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.293 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 . . . . . 0 N--CA 1.454 -0.23 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.692 -179.695 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 81.4 m . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.667 0.27 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -73.78 -64.56 0.97 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.04 -38.51 65.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.823 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.35 -47.11 74.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.961 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 m -67.87 -28.34 67.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.092 0.472 . . . . 0.0 111.005 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.3 mtm -71.2 -42.82 68.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.528 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -66.62 -35.88 81.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -26.03 59.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.031 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -117.85 43.99 2.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.185 0.517 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.31 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.05 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 . . . . . 0 C--O 1.224 -0.252 0 CA-C-O 121.528 0.68 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -54.78 -44.88 73.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.249 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -51.31 -47.82 62.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.21 0.528 . . . . 0.0 111.308 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -56.62 -35.73 68.64 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.049 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 30.8 t -74.74 -45.22 45.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.28 -41.06 91.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.198 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -38.69 61.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.492 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -74.9 -52.38 11.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.18 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.63 -54.84 36.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.246 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 . . . . . 0 C--O 1.24 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.655 179.884 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.9 m . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.995 0.426 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -75.68 -63.29 1.33 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.978 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.55 -36.96 56.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.79 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -67.39 -51.77 47.89 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.379 0.424 . . . . 0.0 111.035 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 m -65.24 -25.19 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.487 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 55.8 mtp -72.39 -43.01 64.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.122 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtt-85 -66.75 -36.28 82.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.86 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -73.83 -26.27 60.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.077 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -118.04 43.82 2.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.819 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 C--O 1.235 0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -179.868 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.851 0.357 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -53.85 -45.8 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 121.363 0.602 . . . . 0.0 111.228 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -44.74 62.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.947 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.65 -35.78 73.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.39 0.614 . . . . 0.0 111.325 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.72 -44.18 43.26 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.9 t -64.0 -41.75 93.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.219 0.533 . . . . 0.0 111.277 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -38.22 59.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.059 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -74.77 -52.37 11.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.011 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.4 t -55.17 -55.05 35.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 . . . . . 0 N--CA 1.464 0.253 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.063 -179.99 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.049 0.452 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -72.44 -63.84 1.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.491 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.4 t -55.31 -37.13 66.98 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.562 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.63 -47.14 76.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 111.143 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -69.61 -28.57 66.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.296 0.57 . . . . 0.0 110.795 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.7 mtt -68.49 -46.25 70.19 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.215 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -36.2 83.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.847 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.0 -25.92 60.17 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.907 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -117.79 40.04 3.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.823 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.548 0 O-C-N 123.176 0.297 . . . . 0.0 110.421 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.343 0.592 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.7 t -56.53 -40.93 71.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.637 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -45.39 63.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.29 -35.7 72.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.089 0.471 . . . . 0.0 110.401 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.8 t -75.52 -44.57 42.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.923 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -64.21 -41.16 91.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.886 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.4 t -52.5 -38.12 58.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.311 0.576 . . . . 0.0 110.935 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -75.0 -53.07 9.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.755 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -54.68 -55.06 33.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.015 -179.915 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.456 -0.156 0 CA-C-O 121.041 0.448 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -65.27 -63.72 1.03 Allowed 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.982 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -40.3 64.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -66.14 -47.97 72.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.575 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 m -64.67 -33.28 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.791 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtm -66.77 -44.42 81.4 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.581 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -66.81 -36.02 81.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.916 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -74.02 -27.82 61.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.793 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -118.24 35.53 4.71 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.465 0.478 . . . . 0.0 110.577 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 . . . . . 0 C--N 1.327 -0.387 0 O-C-N 123.458 0.474 . . . . 0.0 110.626 179.994 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 . . . . . 0 N--CA 1.463 0.204 0 CA-C-O 120.544 0.211 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -59.81 -42.08 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.649 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -51.74 -48.47 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.338 0.399 . . . . 0.0 110.789 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.52 -35.28 63.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.095 0.474 . . . . 0.0 111.081 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.0 t -75.62 -45.55 36.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.339 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.66 -40.19 87.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.389 0.614 . . . . 0.0 111.533 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.02 -42.24 80.01 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.067 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.22 -52.42 10.94 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.565 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.8 t -54.0 -43.76 70.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.786 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.8 m . . . . . 0 C--O 1.24 0.581 0 CA-C-O 120.643 0.259 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.6 -63.89 1.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.919 0.39 . . . . 0.0 111.209 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -54.89 -36.84 65.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.799 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -65.76 -45.93 80.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.865 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.28 -26.42 61.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.691 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 mtm -71.84 -44.78 63.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.899 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -67.45 -36.29 80.9 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.018 0.437 . . . . 0.0 110.74 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -72.12 -26.11 62.0 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.906 0.384 . . . . 0.0 111.174 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.91 49.13 1.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.869 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 C--N 1.323 -0.547 0 O-C-N 123.547 0.53 . . . . 0.0 111.055 -179.924 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.874 0.368 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.35 -42.23 56.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.429 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -50.79 -48.52 59.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.136 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.16 -34.94 68.96 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.595 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 t -74.8 -44.82 47.37 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.064 0.459 . . . . 0.0 110.735 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.4 t -64.82 -41.78 93.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.088 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.33 -38.02 57.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.116 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -74.91 -52.89 10.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.1 t -54.96 -54.24 45.43 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.433 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 . . . . . 0 CA--C 1.534 0.333 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.527 -179.8 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.7 m . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.985 0.421 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -73.38 -64.17 1.04 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.028 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -55.38 -36.06 65.96 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -65.62 -46.07 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.263 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -73.02 -25.44 60.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.567 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.2 mtm -71.76 -45.23 62.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.203 0.525 . . . . 0.0 111.085 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmm-85 -68.13 -34.96 77.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -72.24 -27.04 62.26 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.759 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.74 49.77 1.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.345 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.45 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.3 t -54.49 -42.22 58.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.009 0.433 . . . . 0.0 111.399 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -51.17 -48.12 61.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.954 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.32 -34.63 68.93 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.794 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.2 t -75.38 -44.33 45.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.264 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.85 -41.37 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.358 0.599 . . . . 0.0 111.45 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -55.29 -39.82 70.32 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.805 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -75.03 -51.17 14.23 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.0 0.429 . . . . 0.0 111.071 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.2 t -55.3 -54.31 45.13 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.8 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 . . . . . 0 C--N 1.328 -0.357 0 CA-C-O 121.096 0.474 . . . . 0.0 110.793 -179.828 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.2 m . . . . . 0 C--O 1.234 0.258 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -64.45 -63.99 0.99 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -57.36 -36.01 70.67 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.52 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -67.84 -43.83 78.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.68 -31.15 64.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.742 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.2 mtm -67.49 -46.96 71.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.569 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -65.72 -35.57 81.11 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.136 0.493 . . . . 0.0 111.215 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -73.07 -25.64 60.97 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -119.13 49.48 1.33 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.498 0.499 . . . . 0.0 110.989 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.032 -179.687 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -54.16 -35.9 30.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.105 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -54.34 43.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.54 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -55.03 -32.56 61.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.3 t -75.35 -44.65 43.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.01 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -65.48 -40.6 88.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.722 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -56.88 -42.48 79.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 110.526 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -75.22 -52.44 10.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.816 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.1 t -55.05 -42.74 73.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.43 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m . . . . . 0 C--O 1.235 0.303 0 CA-C-O 121.4 0.619 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -64.5 0.85 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.8 t -55.61 -34.08 64.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.184 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -65.2 -46.16 81.82 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.902 0.382 . . . . 0.0 110.715 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.5 m -75.99 -25.94 56.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 41.3 mtp -63.88 -55.4 23.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.831 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -65.15 -38.72 91.5 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.56 0.537 . . . . 0.0 110.882 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 -63.94 -25.43 68.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 110.919 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -120.38 50.2 1.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.81 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.946 -179.88 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.763 0.316 . . . . 0.0 111.085 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.0 t -54.39 -38.22 39.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.085 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -55.21 28.16 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.639 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.22 -32.63 56.36 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.654 0.596 . . . . 0.0 111.141 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.8 t -75.37 -45.19 40.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.646 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.95 -42.12 93.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.995 0.426 . . . . 0.0 110.996 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.6 t -51.29 -38.46 52.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.353 0.597 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.51 -52.46 10.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.676 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.4 t -54.89 -55.11 34.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.788 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 110.785 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.22 -64.26 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.723 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.3 t -57.6 -34.46 69.28 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.108 0.48 . . . . 0.0 110.636 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -68.77 -44.8 72.91 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.63 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -71.6 -32.0 67.54 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.389 0.614 . . . . 0.0 111.02 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 mtm -67.85 -46.52 71.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -65.98 -35.77 81.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.862 0.363 . . . . 0.0 111.099 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ttt85 -71.76 -28.29 63.54 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.52 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -117.51 50.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.139 0.495 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.607 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.9 t -54.05 -41.65 51.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.517 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.76 -48.07 63.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.124 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.96 -35.73 69.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.547 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -74.89 -44.52 48.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.646 0.26 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.3 -40.24 87.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.046 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t -57.56 -46.83 83.46 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.038 0.447 . . . . 0.0 110.773 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.33 -49.42 19.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.9 t -54.52 -46.31 73.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.726 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.803 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 121.086 0.469 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -64.54 1.02 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -54.4 -37.87 65.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.937 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -66.84 -47.1 73.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.114 0.483 . . . . 0.0 110.806 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.1 m -67.12 -35.23 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.7 mtm -65.57 -41.48 92.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.502 0.668 . . . . 0.0 111.142 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.5 -39.11 93.18 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.682 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -74.58 -26.72 60.12 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.01 0.434 . . . . 0.0 110.633 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -117.31 45.48 1.89 Allowed 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.951 179.933 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.569 0.223 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.22 -44.78 66.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.932 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -53.65 46.37 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.561 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -55.16 -32.73 62.36 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.041 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -74.74 -45.18 45.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.145 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.16 -41.38 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-O 121.676 0.751 . . . . 0.0 111.279 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -38.19 58.82 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.698 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -75.53 -51.87 11.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.906 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.6 t -54.85 -55.51 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.392 0.615 . . . . 0.0 110.996 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.808 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.8 m . . . . . 0 C--O 1.238 0.47 0 CA-C-O 120.75 0.31 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -64.7 0.94 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.889 0.376 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -53.65 -38.1 63.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.631 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -65.82 -48.33 72.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.4 m -67.9 -29.48 68.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.0 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.75 -47.11 70.19 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.223 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -65.11 -35.88 82.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -73.13 -27.12 61.5 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.953 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -117.93 41.18 2.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.921 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.803 0.335 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.5 t -57.97 -40.73 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 121.044 0.449 . . . . 0.0 111.367 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -51.4 -48.43 62.62 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.624 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -56.2 -34.69 66.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.943 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -75.06 -44.16 49.16 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.266 0.555 . . . . 0.0 111.132 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -64.9 -41.71 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.805 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.0 t -52.01 -37.71 54.32 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.442 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -74.95 -52.71 10.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.394 0.616 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.43 -55.77 25.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.862 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.868 179.981 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.5 m . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 121.12 0.486 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -73.49 -63.77 1.13 Allowed 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.931 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -54.43 -38.03 65.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.224 0.535 . . . . 0.0 110.778 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -64.41 -47.07 80.56 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.736 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 m -71.42 -24.8 62.1 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.747 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 17.4 mtm -72.99 -43.68 61.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.218 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -68.74 -35.9 77.7 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.672 0.607 . . . . 0.0 111.032 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -71.6 -28.65 63.95 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.595 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -117.72 48.31 1.4 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.054 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 . . . . . 0 CA--C 1.517 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.034 -179.904 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 121.052 0.453 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -55.53 -34.06 34.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.068 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.35 -55.84 24.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.7 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.03 -31.35 61.01 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.576 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.7 t -75.7 -44.95 39.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.974 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.6 t -65.17 -41.13 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.57 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.4 t -52.49 -37.9 58.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.865 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.2 -52.67 10.36 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.834 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.3 t -54.6 -55.18 32.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.028 0.442 . . . . 0.0 110.634 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 . . . . . 0 N--CA 1.461 0.104 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 -179.515 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m . . . . . 0 C--O 1.239 0.505 0 CA-C-O 120.58 0.229 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.12 -63.83 1.1 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.924 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.9 m -53.39 -39.34 64.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.057 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.98 -48.05 80.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.983 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.6 m -70.84 -24.9 62.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.707 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.9 mtm -72.63 -44.17 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.886 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -69.1 -35.25 76.25 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.772 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -72.01 -28.75 63.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.643 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -117.42 48.51 1.34 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.795 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.66 0.267 . . . . 0.0 110.894 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.7 t -55.03 -34.74 32.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.997 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -55.09 34.85 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.701 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -54.83 -31.9 59.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.522 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.8 t -75.98 -44.4 39.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 123.589 0.556 . . . . 0.0 111.062 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -65.6 -41.31 90.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.909 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -37.67 57.79 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -75.23 -52.58 10.56 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.325 0.583 . . . . 0.0 111.186 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -55.07 -54.89 37.35 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.955 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ttm180 . . . . . 0 C--O 1.235 0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.921 179.826 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.2 m . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.26 -64.32 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.202 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 t -52.13 -36.49 51.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.063 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -67.29 -51.43 52.83 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.127 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.2 m -64.51 -29.01 70.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.9 mtp -68.92 -47.19 66.37 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.806 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -65.62 -36.41 83.64 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.676 0.61 . . . . 0.0 110.94 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ttt-85 -71.82 -26.26 62.32 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -117.98 48.95 1.3 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.239 0.507 0 CA-C-O 121.101 0.477 . . . . 0.0 110.746 -179.494 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.794 0.331 . . . . 0.0 110.805 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.4 t -54.83 -35.0 32.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.109 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -54.27 42.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.12 -32.75 55.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.957 0.408 . . . . 0.0 111.182 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -75.55 -44.71 42.01 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.753 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 68.9 t -65.1 -41.81 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.233 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -52.05 -38.5 57.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.958 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -74.46 -52.75 11.1 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.053 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.4 t -54.94 -54.93 36.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.691 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 -179.819 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 86.8 m . . . . . 0 C--O 1.236 0.362 0 CA-C-O 120.976 0.417 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -64.09 -64.28 0.93 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.236 0.541 . . . . 0.0 111.306 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 t -56.52 -36.43 69.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.2 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -67.03 -44.57 79.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.705 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.4 m -71.63 -30.79 66.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.801 0.334 . . . . 0.0 111.192 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.8 mtm -69.32 -44.85 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.41 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -68.34 -35.56 77.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.672 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -71.79 -25.87 62.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.06 0.457 . . . . 0.0 111.505 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -118.53 49.51 1.28 Allowed 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.19 179.798 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.475 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.1 t -54.69 -35.4 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.829 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.78 -53.23 51.17 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.255 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.03 -32.35 61.79 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.688 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -75.76 -45.54 35.82 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.258 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.14 -40.11 87.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.231 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -53.25 -37.41 62.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -75.34 -55.81 5.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.388 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -53.96 -34.68 60.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.659 0.743 . . . . 0.0 111.337 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.238 0.483 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.812 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.2 m . . . . . 0 C--O 1.237 0.413 0 CA-C-O 120.663 0.268 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -73.67 -63.9 1.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.811 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -55.65 -36.21 66.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.824 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -66.62 -46.05 77.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.992 0.425 . . . . 0.0 110.64 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -71.45 -27.87 63.56 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 mtm -69.65 -45.78 67.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.057 0.456 . . . . 0.0 110.757 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.97 -36.13 82.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.815 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ttt85 -73.44 -26.01 60.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.616 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -118.58 48.53 1.43 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.706 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.744 -179.354 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 120.784 0.326 . . . . 0.0 110.762 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.6 t -54.69 -36.97 38.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.735 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.61 -54.82 32.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.058 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.37 -32.77 57.76 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -75.29 -44.53 45.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.082 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.9 t -65.59 -41.62 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 t -52.2 -38.17 57.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.521 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -75.02 -53.06 9.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 0.0 111.009 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.7 t -54.77 -55.25 32.05 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.415 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 . . . . . 0 N--CA 1.448 -0.558 0 CA-C-O 121.397 0.618 . . . . 0.0 111.286 -179.93 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.1 m . . . . . 0 C--O 1.236 0.361 0 CA-C-O 120.782 0.325 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -73.95 -63.72 1.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.161 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.8 t -52.91 -35.78 58.7 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.801 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -66.25 -52.11 50.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.138 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.4 m -66.65 -25.21 66.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 52.2 mtp -72.49 -45.01 61.46 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.531 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -68.56 -35.92 78.07 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.48 -28.16 63.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -117.8 50.84 1.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.595 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.592 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.338 0 CA-C-O 121.096 0.474 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.6 -43.79 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.246 0.546 . . . . 0.0 110.947 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -51.05 -45.68 61.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.151 0.501 . . . . 0.0 111.236 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.87 -34.76 71.97 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.408 0.623 . . . . 0.0 110.959 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.5 t -75.47 -44.42 44.19 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.138 0.494 . . . . 0.0 110.806 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.7 t -65.37 -41.42 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.045 0.45 . . . . 0.0 111.377 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.1 m -52.04 -37.98 55.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.801 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -75.95 -51.87 11.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.666 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.6 t -55.58 -54.22 46.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.088 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.081 179.655 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--O 1.24 0.601 0 CA-C-O 120.809 0.338 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.39 -64.09 1.02 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.766 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -41.66 60.06 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.633 0.254 . . . . 0.0 111.135 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -65.04 -49.32 70.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.765 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.1 m -62.6 -36.45 82.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.232 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.8 mtm -64.17 -47.06 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.652 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -64.74 -36.14 83.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.805 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -74.25 -30.21 62.04 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.207 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -115.71 35.92 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.168 0.509 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 . . . . . 0 C--O 1.221 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.025 179.958 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.921 0.391 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.1 t -59.39 -39.85 80.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.653 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -51.8 63.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.982 0.42 . . . . 0.0 110.978 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.39 -32.49 57.28 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -74.81 -45.32 44.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.235 0.54 . . . . 0.0 111.045 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.08 -41.48 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.422 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -37.54 59.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.31 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -75.0 -52.2 11.71 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.442 0.639 . . . . 0.0 111.364 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -54.91 -55.35 31.54 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.958 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.017 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m 61.86 32.59 17.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.926 0.393 . . . . 0.0 110.992 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.84 173.8 0.78 Allowed Glycine 0 C--O 1.228 -0.247 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.867 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.08 168.69 9.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.006 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.5 77.16 1.24 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.379 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.43 145.52 21.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.547 0.213 . . . . 0.0 111.412 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.8 m -59.29 -27.68 66.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.882 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -64.2 -64.33 0.91 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.281 0.563 . . . . 0.0 110.943 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.16 -34.68 66.4 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.737 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -68.04 -47.46 68.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.427 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -71.19 -26.53 63.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.108 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.2 mtm -69.04 -48.62 62.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.085 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -68.2 -35.67 78.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.333 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -69.34 -27.07 65.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -118.48 49.22 1.31 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.902 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.17 -26.5 68.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.657 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -81.66 -25.72 35.35 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.208 0.528 . . . . 0.0 111.317 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -145.63 75.57 13.31 Favored Pre-proline 0 C--O 1.236 0.392 0 CA-C-O 121.881 0.848 . . . . 0.0 111.151 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.5 -7.59 21.39 Favored 'Trans proline' 0 C--O 1.22 -0.38 0 C-N-CA 122.89 2.393 . . . . 0.0 112.567 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.1 m95 -75.95 -14.76 60.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.711 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.57 0.49 26.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.521 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.26 -39.45 43.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.023 0.44 . . . . 0.0 111.198 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -50.85 -48.16 60.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.002 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.74 -35.73 71.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -75.13 -43.73 51.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.247 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 73.5 t -64.77 -40.81 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-O 120.808 0.337 . . . . 0.0 111.024 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 t -57.59 -45.64 85.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.946 0.403 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.48 -49.18 19.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.431 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 44.0 t -55.19 -45.29 75.81 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -63.74 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -54.41 155.4 3.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.857 0.361 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 53.04 59.0 4.75 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.699 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.5 ptt-85 -87.12 -16.28 35.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.974 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.77 -29.15 71.28 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.218 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.41 48.12 0.01 OUTLIER Glycine 0 CA--C 1.516 0.134 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.037 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.59 168.62 21.83 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.737 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.435 0.117 . . . . 0.0 111.276 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 N-CA-C 112.529 -0.228 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m 51.98 53.43 12.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.277 0.56 . . . . 0.0 111.072 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 101.31 27.6 7.19 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.548 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.92 -173.83 0.11 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.156 0.503 . . . . 0.0 111.124 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -153.92 103.85 0.24 Allowed Glycine 0 C--N 1.334 0.443 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.62 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.08 141.34 52.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.004 0.431 . . . . 0.0 110.977 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -53.88 -28.67 37.7 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.953 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -72.58 -63.81 1.08 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.839 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.7 t -55.06 -35.89 65.0 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.099 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -65.53 -47.16 76.87 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.399 0.437 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.79 -26.66 62.51 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.04 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.5 mtm -71.07 -44.76 65.07 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -36.4 82.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.489 0.661 . . . . 0.0 111.073 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -72.14 -28.58 63.34 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -117.31 49.02 1.24 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.789 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -26.87 68.72 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 123.44 0.462 . . . . 0.0 110.523 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.95 -46.89 13.4 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -118.2 74.02 10.46 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 121.796 0.808 . . . . 0.0 111.484 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.9 -7.44 21.11 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.003 2.469 . . . . 0.0 112.446 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.46 -14.05 60.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.89 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.36 0.27 26.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.974 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.0 t -55.28 -42.51 66.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 O-C-N 123.597 0.561 . . . . 0.0 110.611 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.16 -48.99 61.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.776 0.322 . . . . 0.0 110.693 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.57 -34.4 67.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.847 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.67 -43.92 45.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.75 -40.96 89.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.165 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.23 -38.44 58.02 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 121.02 0.438 . . . . 0.0 110.849 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.38 -52.37 10.93 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.599 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -54.63 -54.66 38.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.293 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -61.12 -30.12 70.18 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.692 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -65.16 98.59 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.268 0.556 . . . . 0.0 110.609 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -88.09 42.97 1.09 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.682 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -15.95 27.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.678 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.43 -68.89 1.5 Allowed Glycine 0 C--O 1.239 0.439 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.33 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 55.94 27.42 Favored Glycine 0 C--N 1.319 -0.384 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.27 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -157.58 -173.79 26.46 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.673 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.7 t70 . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.849 0.357 . . . . 0.0 110.878 179.819 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.376 -0.29 . . . . 0.0 112.376 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.0 m 54.84 71.37 0.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.791 0.329 . . . . 0.0 111.045 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 164.58 143.29 3.66 Favored Glycine 0 C--O 1.238 0.376 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.19 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.39 139.71 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.866 0.365 . . . . 0.0 110.693 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -131.87 129.68 5.7 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.423 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.8 p -62.24 146.72 50.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 110.897 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 81.4 m -56.72 -26.39 56.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -73.78 -64.56 0.97 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.04 -38.51 65.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.823 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.35 -47.11 74.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.961 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 m -67.87 -28.34 67.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.092 0.472 . . . . 0.0 111.005 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.3 mtm -71.2 -42.82 68.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.528 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -66.62 -35.88 81.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -26.03 59.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.031 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -117.85 43.99 2.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.185 0.517 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.04 -26.1 68.12 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.05 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -87.6 -26.68 22.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.073 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -139.72 69.88 37.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.806 0.812 . . . . 0.0 110.599 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.78 -5.84 17.17 Favored 'Trans proline' 0 N--CA 1.475 0.384 0 C-N-CA 122.611 2.208 . . . . 0.0 112.343 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -71.2 -17.77 62.51 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.433 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -106.13 8.58 32.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.528 0.68 . . . . 0.0 111.166 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -54.78 -44.88 73.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.249 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -51.31 -47.82 62.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.21 0.528 . . . . 0.0 111.308 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -56.62 -35.73 68.64 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.049 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 30.8 t -74.74 -45.22 45.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.28 -41.06 91.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.198 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -38.69 61.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.492 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -74.9 -52.38 11.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.18 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.63 -54.84 36.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.246 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -61.61 -67.16 0.44 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.655 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.86 93.4 0.55 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.816 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptp85 -87.95 43.1 1.09 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.827 0.346 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.63 -16.49 60.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.343 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -88.66 -123.55 2.14 Favored Glycine 0 CA--C 1.509 -0.316 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.822 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -147.64 -116.73 0.93 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.617 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -59.12 143.56 45.76 Favored Glycine 0 CA--C 1.508 -0.404 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.532 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.325 -0.496 0 O-C-N 122.665 -0.315 . . . . 0.0 110.755 -179.859 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.432 0 N-CA-C 112.259 -0.336 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.1 m -89.28 -70.08 0.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.961 0.41 . . . . 0.0 111.171 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.57 -96.69 0.12 Allowed Glycine 0 C--O 1.229 -0.164 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.332 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.68 175.42 5.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.586 0.193 . . . . 0.0 111.07 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.66 136.26 0.05 OUTLIER Glycine 0 CA--C 1.526 0.77 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.403 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -75.33 -177.35 3.49 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 120.865 0.364 . . . . 0.0 110.67 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.9 m -63.66 -16.33 60.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.095 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -75.68 -63.29 1.33 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.978 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.55 -36.96 56.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.79 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -67.39 -51.77 47.89 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.379 0.424 . . . . 0.0 111.035 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 m -65.24 -25.19 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.487 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 55.8 mtp -72.39 -43.01 64.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.122 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtt-85 -66.75 -36.28 82.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.86 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -73.83 -26.27 60.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.077 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -118.04 43.82 2.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.819 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -65.67 -25.15 67.21 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -87.96 -26.07 22.86 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 121.196 0.522 . . . . 0.0 110.676 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -140.76 69.62 30.41 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 122.284 1.04 . . . . 0.0 111.31 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.28 -5.46 15.96 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.697 2.265 . . . . 0.0 112.225 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -71.68 -18.17 62.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.481 0.488 . . . . 0.0 111.08 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -105.75 8.24 32.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.663 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -53.85 -45.8 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 121.363 0.602 . . . . 0.0 111.228 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -44.74 62.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.947 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.65 -35.78 73.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.39 0.614 . . . . 0.0 111.325 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.72 -44.18 43.26 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.9 t -64.0 -41.75 93.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.219 0.533 . . . . 0.0 111.277 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -38.22 59.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.059 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -74.77 -52.37 11.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.011 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.4 t -55.17 -55.05 35.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 -59.99 -64.73 0.84 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.063 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -65.85 178.75 1.0 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.363 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 mtt85 52.67 47.61 24.31 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.971 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -95.26 24.83 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.045 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -88.89 -38.74 6.77 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.331 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.2 -52.38 0.53 Allowed Glycine 0 C--O 1.226 -0.362 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.45 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 139.61 -144.96 15.84 Favored Glycine 0 C--O 1.222 -0.648 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.944 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.408 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.535 0 N-CA-C 112.321 -0.311 . . . . 0.0 112.321 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.62 166.21 12.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.405 0.621 . . . . 0.0 111.004 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.75 -114.31 0.74 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.756 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -103.88 168.88 8.84 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.693 0.282 . . . . 0.0 110.829 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -174.06 158.5 27.28 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.899 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.2 144.21 20.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.599 -0.354 . . . . 0.0 110.796 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -59.72 -26.11 65.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.221 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -72.44 -63.84 1.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.491 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.4 t -55.31 -37.13 66.98 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.562 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.63 -47.14 76.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 111.143 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -69.61 -28.57 66.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.296 0.57 . . . . 0.0 110.795 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.7 mtt -68.49 -46.25 70.19 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.215 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -36.2 83.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.847 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.0 -25.92 60.17 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.907 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -117.79 40.04 3.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.823 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.48 68.32 Favored 'General case' 0 C--O 1.239 0.548 0 O-C-N 123.176 0.297 . . . . 0.0 110.421 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -85.31 -25.97 26.86 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.327 0.392 . . . . 0.0 110.708 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -139.88 70.66 36.15 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 121.722 0.772 . . . . 0.0 111.232 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.53 -7.0 19.85 Favored 'Trans proline' 0 N--CA 1.475 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.232 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -79.08 10.18 3.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.656 0.265 . . . . 0.0 111.065 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -137.19 7.58 2.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.343 0.592 . . . . 0.0 110.952 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.7 t -56.53 -40.93 71.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.637 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -45.39 63.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.29 -35.7 72.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.089 0.471 . . . . 0.0 110.401 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.8 t -75.52 -44.57 42.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.923 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -64.21 -41.16 91.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.886 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.4 t -52.5 -38.12 58.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.311 0.576 . . . . 0.0 110.935 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -75.0 -53.07 9.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.755 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -54.68 -55.06 33.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -60.17 -30.4 69.3 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.015 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 159.09 24.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.553 0.692 . . . . 0.0 110.221 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.62 3.93 34.64 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.296 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.47 -16.71 25.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.68 -109.08 0.2 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.327 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.93 -61.24 0.09 OUTLIER Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.841 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.37 132.16 7.49 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.224 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.0 t0 . . . . . 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 110.607 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.464 0 N-CA-C 112.379 -0.288 . . . . 0.0 112.379 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.46 179.32 7.44 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 120.955 0.407 . . . . 0.0 111.139 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.97 -171.17 47.75 Favored Glycine 0 N--CA 1.458 0.154 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.335 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -150.72 72.75 1.09 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.664 0.268 . . . . 0.0 111.176 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.82 115.86 0.34 Allowed Glycine 0 CA--C 1.511 -0.205 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.336 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -72.89 158.79 34.84 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.393 -0.475 . . . . 0.0 110.62 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.3 m -58.93 -31.34 68.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.927 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -65.27 -63.72 1.03 Allowed 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.982 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -40.3 64.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -66.14 -47.97 72.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.575 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 m -64.67 -33.28 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.791 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtm -66.77 -44.42 81.4 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.581 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -66.81 -36.02 81.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.916 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -74.02 -27.82 61.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.793 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -118.24 35.53 4.71 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.465 0.478 . . . . 0.0 110.577 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -60.14 -26.41 66.26 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.458 0.474 . . . . 0.0 110.626 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -83.7 -25.87 30.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.03 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -139.32 71.49 39.24 Favored Pre-proline 0 N--CA 1.455 -0.208 0 CA-C-O 121.765 0.793 . . . . 0.0 111.07 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.31 -4.97 15.48 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.033 2.489 . . . . 0.0 112.114 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -76.01 -0.61 22.28 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.604 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -129.61 12.94 5.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.692 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -59.81 -42.08 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.649 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -51.74 -48.47 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.338 0.399 . . . . 0.0 110.789 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.52 -35.28 63.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.095 0.474 . . . . 0.0 111.081 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.0 t -75.62 -45.55 36.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.339 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.66 -40.19 87.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.389 0.614 . . . . 0.0 111.533 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.02 -42.24 80.01 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.067 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.22 -52.42 10.94 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.565 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.8 t -54.0 -43.76 70.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -64.9 -64.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.786 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -54.81 137.9 43.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.141 0.496 . . . . 0.0 110.65 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -85.37 3.88 37.84 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.671 0.748 . . . . 0.0 111.222 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -94.51 41.13 1.09 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.924 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -108.07 -75.39 0.9 Allowed Glycine 0 CA--C 1.509 -0.317 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.205 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 148.05 -60.32 0.45 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.645 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 141.16 -178.91 19.88 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.339 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 121.143 0.497 . . . . 0.0 110.482 -179.67 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.299 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -73.69 157.12 37.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.93 0.395 . . . . 0.0 110.95 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.59 -174.19 45.83 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.665 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 53.27 75.24 0.26 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.909 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -106.63 -87.23 1.94 Allowed Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.266 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.35 148.81 25.06 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 122.306 -0.526 . . . . 0.0 111.167 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.8 m -56.82 -27.67 60.38 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 120.643 0.259 . . . . 0.0 110.307 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.6 -63.89 1.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.919 0.39 . . . . 0.0 111.209 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -54.89 -36.84 65.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.799 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -65.76 -45.93 80.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.865 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.28 -26.42 61.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.691 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 mtm -71.84 -44.78 63.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.899 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -67.45 -36.29 80.9 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.018 0.437 . . . . 0.0 110.74 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -72.12 -26.11 62.0 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.906 0.384 . . . . 0.0 111.174 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.91 49.13 1.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.869 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.7 -26.28 68.31 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.547 0.53 . . . . 0.0 111.055 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -82.46 -40.04 21.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -127.17 74.31 77.09 Favored Pre-proline 0 C--N 1.329 -0.289 0 O-C-N 123.788 0.68 . . . . 0.0 110.91 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.68 -8.09 22.7 Favored 'Trans proline' 0 C--N 1.337 -0.072 0 C-N-CA 122.921 2.414 . . . . 0.0 112.27 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -14.22 60.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.048 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.23 0.03 26.85 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.568 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.35 -42.23 56.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.429 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -50.79 -48.52 59.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.136 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.16 -34.94 68.96 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.595 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 t -74.8 -44.82 47.37 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.064 0.459 . . . . 0.0 110.735 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.4 t -64.82 -41.78 93.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.088 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.33 -38.02 57.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.116 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -74.91 -52.89 10.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.1 t -54.96 -54.24 45.43 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.433 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -60.95 -65.67 0.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.527 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -65.59 108.38 2.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.011 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -86.69 13.58 8.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.024 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.82 13.93 1.91 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.677 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -102.95 -19.94 12.16 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.396 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -152.18 -63.76 0.01 OUTLIER Glycine 0 C--O 1.226 -0.403 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.14 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 150.2 171.18 18.31 Favored Glycine 0 C--O 1.238 0.386 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.724 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.988 0.423 . . . . 0.0 110.836 179.874 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.454 0 CA-C-O 120.904 0.169 . . . . 0.0 112.836 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 t 61.92 -177.75 0.13 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 122.053 -0.675 . . . . 0.0 110.741 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 100.77 72.47 0.99 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.312 -0.471 . . . . 0.0 112.403 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 45.23 -164.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.861 -0.2 . . . . 0.0 111.051 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -174.66 121.26 0.82 Allowed Glycine 0 C--O 1.23 -0.124 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.277 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -75.4 -177.55 3.62 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.91 0.386 . . . . 0.0 110.707 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.7 m -63.37 -16.52 60.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.865 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -73.38 -64.17 1.04 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.028 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -55.38 -36.06 65.96 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -65.62 -46.07 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.263 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -73.02 -25.44 60.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.567 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.2 mtm -71.76 -45.23 62.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.203 0.525 . . . . 0.0 111.085 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmm-85 -68.13 -34.96 77.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -72.24 -27.04 62.26 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.759 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.74 49.77 1.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.32 -26.64 68.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.345 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -82.14 -39.64 22.98 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -127.3 74.77 77.38 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-O 121.744 0.783 . . . . 0.0 111.002 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.39 -7.4 21.15 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.746 2.297 . . . . 0.0 112.067 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 9.8 t-105 -75.82 -14.84 60.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.425 0.631 . . . . 0.0 111.005 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.35 0.32 26.88 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.398 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.3 t -54.49 -42.22 58.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.009 0.433 . . . . 0.0 111.399 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -51.17 -48.12 61.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.954 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.32 -34.63 68.93 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.794 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.2 t -75.38 -44.33 45.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.264 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.85 -41.37 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.358 0.599 . . . . 0.0 111.45 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -55.29 -39.82 70.32 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.805 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -75.03 -51.17 14.23 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.0 0.429 . . . . 0.0 111.071 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.2 t -55.3 -54.31 45.13 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.8 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 -61.7 -32.36 72.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.096 0.474 . . . . 0.0 110.793 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 143.56 50.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.712 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 62.17 55.46 2.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.039 0.447 . . . . 0.0 110.563 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -94.8 38.47 1.12 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.857 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.1 -41.33 1.08 Allowed Glycine 0 C--O 1.236 0.241 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.226 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.42 -101.12 0.01 OUTLIER Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.195 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -88.26 -144.26 9.62 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.501 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.3 t0 . . . . . 0 C--N 1.332 -0.17 0 CA-C-O 120.872 0.368 . . . . 0.0 111.065 179.871 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 N-CA-C 112.826 -0.11 . . . . 0.0 112.826 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.9 p -159.86 163.7 34.18 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 121.05 0.452 . . . . 0.0 111.067 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 149.76 144.85 4.02 Favored Glycine 0 C--O 1.221 -0.718 0 C-N-CA 121.247 -0.501 . . . . 0.0 112.466 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 60.39 99.74 0.03 OUTLIER 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.795 0.331 . . . . 0.0 111.012 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -127.95 115.18 2.03 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.763 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.48 143.36 19.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.98 0.419 . . . . 0.0 111.024 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.2 m -57.33 -27.76 62.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -64.45 -63.99 0.99 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -57.36 -36.01 70.67 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.52 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -67.84 -43.83 78.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.68 -31.15 64.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.742 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.2 mtm -67.49 -46.96 71.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.569 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -65.72 -35.57 81.11 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.136 0.493 . . . . 0.0 111.215 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -73.07 -25.64 60.97 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -119.13 49.48 1.33 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.498 0.499 . . . . 0.0 110.989 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -65.36 -25.94 67.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.032 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -82.29 -34.97 28.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.927 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.55 73.36 72.9 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.692 0.758 . . . . 0.0 110.68 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 -7.76 21.86 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.94 2.427 . . . . 0.0 112.15 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -75.45 -15.1 60.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.237 0.541 . . . . 0.0 110.972 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.66 -0.87 27.07 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -54.16 -35.9 30.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.105 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -54.34 43.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.54 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -55.03 -32.56 61.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.3 t -75.35 -44.65 43.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.01 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -65.48 -40.6 88.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.722 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -56.88 -42.48 79.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 110.526 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -75.22 -52.44 10.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.816 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.1 t -55.05 -42.74 73.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.43 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -62.54 1.48 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -54.76 139.34 39.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.901 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 mtt85 60.53 58.29 2.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.737 0.303 . . . . 0.0 111.002 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.97 42.23 1.1 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.125 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.85 -126.94 1.28 Allowed Glycine 0 N--CA 1.459 0.214 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.469 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -84.57 -73.41 1.27 Allowed Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.418 -179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.5 -135.42 12.15 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.551 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.659 0.266 . . . . 0.0 110.825 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 112.755 -0.138 . . . . 0.0 112.755 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.5 m 61.49 85.48 0.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.819 0.343 . . . . 0.0 111.28 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.06 -97.31 0.07 OUTLIER Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.2 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.43 -174.97 0.16 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.97 0.414 . . . . 0.0 110.532 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.44 141.53 3.9 Favored Glycine 0 CA--C 1.512 -0.147 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.634 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -55.46 164.18 1.07 Allowed 'General case' 0 C--O 1.243 0.735 0 CA-C-O 120.992 0.425 . . . . 0.0 110.847 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.3 -25.38 66.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.4 0.619 . . . . 0.0 111.006 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -64.5 0.85 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.8 t -55.61 -34.08 64.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.184 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -65.2 -46.16 81.82 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.902 0.382 . . . . 0.0 110.715 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.5 m -75.99 -25.94 56.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 41.3 mtp -63.88 -55.4 23.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.831 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -65.15 -38.72 91.5 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.56 0.537 . . . . 0.0 110.882 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 -63.94 -25.43 68.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 110.919 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -120.38 50.2 1.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.81 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -65.28 -25.85 67.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.946 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -83.89 -28.89 27.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.973 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -141.49 74.18 23.95 Favored Pre-proline 0 C--O 1.232 0.172 0 CA-C-O 121.732 0.777 . . . . 0.0 110.569 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.4 -7.77 21.83 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.778 2.319 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -75.36 -15.16 60.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.77 0.62 28.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.085 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.0 t -54.39 -38.22 39.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.085 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -55.21 28.16 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.639 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.22 -32.63 56.36 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.654 0.596 . . . . 0.0 111.141 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.8 t -75.37 -45.19 40.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.646 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.95 -42.12 93.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.995 0.426 . . . . 0.0 110.996 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.6 t -51.29 -38.46 52.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.353 0.597 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.51 -52.46 10.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.676 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.4 t -54.89 -55.11 34.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.788 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -66.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 110.785 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.0 mmt-85 -67.45 -174.93 0.44 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.951 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -173.89 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.712 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.06 -16.02 57.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.122 0.487 . . . . 0.0 111.09 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -110.6 -135.16 6.87 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.691 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -163.24 37.94 0.33 Allowed Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.998 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.59 -159.38 13.89 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.219 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 . . . . . 0 C--N 1.332 -0.171 0 O-C-N 122.614 -0.344 . . . . 0.0 110.622 -179.439 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.705 0 CA-C-O 120.316 -0.158 . . . . 0.0 112.746 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.87 -170.75 3.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.913 0.387 . . . . 0.0 110.879 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 71.38 31.82 65.57 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.324 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -126.46 143.93 51.02 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 122.318 -0.519 . . . . 0.0 110.867 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -139.97 69.88 0.46 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.813 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 p -70.41 162.76 28.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.982 0.42 . . . . 0.0 110.476 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 m -58.91 -28.91 66.65 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.943 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.22 -64.26 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.723 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.3 t -57.6 -34.46 69.28 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.108 0.48 . . . . 0.0 110.636 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -68.77 -44.8 72.91 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.63 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -71.6 -32.0 67.54 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.389 0.614 . . . . 0.0 111.02 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 mtm -67.85 -46.52 71.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -65.98 -35.77 81.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.862 0.363 . . . . 0.0 111.099 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ttt85 -71.76 -28.29 63.54 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.52 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -117.51 50.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.139 0.495 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.61 -26.16 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.607 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -82.8 -42.58 17.73 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.95 0.405 . . . . 0.0 110.745 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -124.06 74.6 58.12 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.812 0.815 . . . . 0.0 110.739 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.01 -8.4 23.52 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.801 2.334 . . . . 0.0 112.116 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -75.34 -14.63 60.49 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.013 0.435 . . . . 0.0 111.283 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.6 -0.6 27.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.126 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.9 t -54.05 -41.65 51.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.517 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.76 -48.07 63.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.124 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.96 -35.73 69.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.547 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -74.89 -44.52 48.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.646 0.26 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.3 -40.24 87.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.046 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t -57.56 -46.83 83.46 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.038 0.447 . . . . 0.0 110.773 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.33 -49.42 19.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.9 t -54.52 -46.31 73.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.726 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.92 -64.03 0.97 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.803 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 155.56 7.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.059 -179.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -158.34 71.79 0.59 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.863 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -142.69 13.84 1.93 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.804 0.335 . . . . 0.0 111.112 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -109.18 -73.02 0.76 Allowed Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.847 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.6 -67.55 0.8 Allowed Glycine 0 CA--C 1.519 0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.223 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 89.53 -176.37 43.09 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.4 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-O 120.617 0.246 . . . . 0.0 111.087 -179.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.509 0 N-CA-C 112.045 -0.422 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.6 t 58.1 66.15 1.16 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.121 0.486 . . . . 0.0 111.041 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 157.81 123.07 0.73 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.353 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -143.28 129.13 19.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.61 0.243 . . . . 0.0 111.032 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -148.8 -170.85 16.98 Favored Glycine 0 CA--C 1.507 -0.406 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.675 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.32 133.48 11.59 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.492 0.187 . . . . 0.0 111.146 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -55.73 -26.09 43.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.086 0.469 . . . . 0.0 111.192 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -64.54 1.02 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -54.4 -37.87 65.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.937 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -66.84 -47.1 73.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.114 0.483 . . . . 0.0 110.806 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.1 m -67.12 -35.23 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.7 mtm -65.57 -41.48 92.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.502 0.668 . . . . 0.0 111.142 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.5 -39.11 93.18 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.682 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -74.58 -26.72 60.12 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.01 0.434 . . . . 0.0 110.633 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -117.31 45.48 1.89 Allowed 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.02 -26.14 68.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.951 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -89.62 -38.57 13.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.533 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -123.32 68.09 37.68 Favored Pre-proline 0 N--CA 1.451 -0.391 0 CA-C-O 121.787 0.804 . . . . 0.0 111.028 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.64 -5.17 15.49 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.665 2.243 . . . . 0.0 112.534 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 5.4 m0 -70.6 -17.94 62.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.724 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -105.81 7.66 32.45 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.291 0.369 . . . . 0.0 110.446 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.22 -44.78 66.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.932 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -53.65 46.37 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.561 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -55.16 -32.73 62.36 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.041 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -74.74 -45.18 45.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.145 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.16 -41.38 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-O 121.676 0.751 . . . . 0.0 111.279 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -38.19 58.82 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.698 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -75.53 -51.87 11.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.906 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.6 t -54.85 -55.51 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.392 0.615 . . . . 0.0 110.996 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -61.26 -66.34 0.55 Allowed 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.33 -173.42 0.41 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.295 0.569 . . . . 0.0 110.499 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 52.57 34.53 15.84 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.396 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -76.42 -16.47 59.69 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.067 0.46 . . . . 0.0 110.978 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -52.21 -54.72 25.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.165 -0.54 . . . . 0.0 112.179 -179.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.61 -106.17 0.2 Allowed Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.944 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.09 -164.57 42.53 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.575 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.2 t70 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.843 0.354 . . . . 0.0 110.626 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.75 149.55 37.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.757 0.313 . . . . 0.0 111.235 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.77 -146.09 44.95 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.287 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -133.01 146.15 51.5 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 120.684 0.278 . . . . 0.0 110.937 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.99 133.01 2.15 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.411 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.84 148.85 24.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.973 0.416 . . . . 0.0 111.055 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.8 m -55.87 -26.35 46.67 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.82 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -64.7 0.94 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.889 0.376 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -53.65 -38.1 63.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.631 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -65.82 -48.33 72.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.4 m -67.9 -29.48 68.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.0 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.75 -47.11 70.19 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.223 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -65.11 -35.88 82.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -73.13 -27.12 61.5 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.953 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -117.93 41.18 2.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.921 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -64.24 -25.11 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.923 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -84.93 -25.43 27.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -140.79 71.52 29.81 Favored Pre-proline 0 N--CA 1.453 -0.295 0 CA-C-O 121.622 0.725 . . . . 0.0 111.177 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.56 -6.22 17.96 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.534 2.156 . . . . 0.0 112.534 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -79.23 10.59 3.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.769 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -138.68 8.34 2.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.472 -179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.5 t -57.97 -40.73 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 121.044 0.449 . . . . 0.0 111.367 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -51.4 -48.43 62.62 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.624 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -56.2 -34.69 66.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.943 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -75.06 -44.16 49.16 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.266 0.555 . . . . 0.0 111.132 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -64.9 -41.71 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.805 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.0 t -52.01 -37.71 54.32 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.442 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -74.95 -52.71 10.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.394 0.616 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.43 -55.77 25.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.862 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -60.0 -35.13 74.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.868 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.67 157.17 5.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.446 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 54.55 65.33 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -16.61 42.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.769 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -162.02 174.55 38.5 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.243 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 172.8 -96.77 0.11 Allowed Glycine 0 C--O 1.222 -0.596 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.489 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -98.28 170.88 25.01 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.246 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.69 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.685 0 N-CA-C 112.27 -0.332 . . . . 0.0 112.27 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.4 t -154.95 87.54 1.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.815 0.341 . . . . 0.0 111.133 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.68 -79.81 1.26 Allowed Glycine 0 C--N 1.329 0.14 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.69 -179.94 3.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.671 0.272 . . . . 0.0 111.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.0 140.06 10.17 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.415 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.57 145.31 21.29 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.768 0.318 . . . . 0.0 110.712 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.5 m -56.24 -27.48 55.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.12 0.486 . . . . 0.0 110.715 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -73.49 -63.77 1.13 Allowed 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.931 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -54.43 -38.03 65.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.224 0.535 . . . . 0.0 110.778 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -64.41 -47.07 80.56 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.736 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 m -71.42 -24.8 62.1 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.747 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 17.4 mtm -72.99 -43.68 61.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.218 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -68.74 -35.9 77.7 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.672 0.607 . . . . 0.0 111.032 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -71.6 -28.65 63.95 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.595 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -117.72 48.31 1.4 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.054 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.11 -26.92 68.75 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -85.98 -27.35 24.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.557 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -138.7 69.91 44.42 Favored Pre-proline 0 C--O 1.231 0.107 0 CA-C-O 121.895 0.855 . . . . 0.0 110.888 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -70.17 -6.46 18.85 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.923 2.415 . . . . 0.0 111.793 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -74.87 -14.63 60.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.42 0.66 27.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.052 0.453 . . . . 0.0 110.912 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -55.53 -34.06 34.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.068 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.35 -55.84 24.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.7 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.03 -31.35 61.01 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.576 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.7 t -75.7 -44.95 39.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.974 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.6 t -65.17 -41.13 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.57 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.4 t -52.49 -37.9 58.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.865 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.2 -52.67 10.36 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.834 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.3 t -54.6 -55.18 32.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.028 0.442 . . . . 0.0 110.634 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -60.66 -30.11 69.7 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.41 111.53 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.465 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 54.14 57.27 6.07 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.485 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -75.38 -16.2 60.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.857 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.89 -35.42 90.77 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 121.15 -0.548 . . . . 0.0 112.04 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.59 68.17 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.642 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.9 173.31 25.5 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.514 -0.85 . . . . 0.0 112.617 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 C--O 1.243 0.75 0 CA-C-O 121.023 0.44 . . . . 0.0 110.979 -179.498 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 CA-C-O 121.049 0.249 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m 60.76 75.28 0.42 Allowed 'General case' 0 C--O 1.235 0.34 0 O-C-N 122.666 -0.314 . . . . 0.0 111.245 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.94 -103.52 0.18 Allowed Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.02 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.88 139.31 53.01 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.803 0.335 . . . . 0.0 110.753 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -139.49 -84.78 0.11 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.582 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.61 145.02 20.99 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.222 0.534 . . . . 0.0 110.824 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -59.13 -27.44 65.63 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.12 -63.83 1.1 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.924 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.9 m -53.39 -39.34 64.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.057 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.98 -48.05 80.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.983 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.6 m -70.84 -24.9 62.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.707 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.9 mtm -72.63 -44.17 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.886 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -69.1 -35.25 76.25 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.772 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -72.01 -28.75 63.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.643 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -117.42 48.51 1.34 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -27.34 69.14 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.795 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.66 -27.41 25.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 0.0 110.839 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.98 69.53 42.41 Favored Pre-proline 0 C--O 1.235 0.337 0 CA-C-O 121.51 0.671 . . . . 0.0 110.886 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.51 -6.59 18.85 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.908 2.405 . . . . 0.0 112.464 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -74.39 -15.02 60.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.772 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.81 0.84 26.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.894 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.7 t -55.03 -34.74 32.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.997 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -55.09 34.85 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.701 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -54.83 -31.9 59.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.522 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.8 t -75.98 -44.4 39.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 123.589 0.556 . . . . 0.0 111.062 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -65.6 -41.31 90.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.909 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -37.67 57.79 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -75.23 -52.58 10.56 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.325 0.583 . . . . 0.0 111.186 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -55.07 -54.89 37.35 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.955 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ttm180 -59.73 -35.0 73.66 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.921 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.0 156.05 9.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.928 0.394 . . . . 0.0 110.73 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -160.31 27.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.162 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -81.51 -15.63 54.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -105.69 -166.08 23.45 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.454 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.9 51.19 0.02 OUTLIER Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.433 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -84.23 -145.95 7.22 Favored Glycine 0 CA--C 1.509 -0.326 0 C-N-CA 120.285 -0.96 . . . . 0.0 112.373 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.946 0.403 . . . . 0.0 110.628 -179.733 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 N-CA-C 112.465 -0.254 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.4 m -148.92 89.39 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.085 0.469 . . . . 0.0 110.904 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.28 127.57 8.11 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.458 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.83 102.75 11.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.115 0.483 . . . . 0.0 110.833 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -113.27 -103.06 2.58 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.37 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.59 146.2 22.07 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.662 0.268 . . . . 0.0 111.033 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.0 -26.92 68.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.576 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.26 -64.32 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.202 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 t -52.13 -36.49 51.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.063 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -67.29 -51.43 52.83 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.127 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.2 m -64.51 -29.01 70.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.9 mtp -68.92 -47.19 66.37 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.806 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -65.62 -36.41 83.64 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.676 0.61 . . . . 0.0 110.94 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ttt-85 -71.82 -26.26 62.32 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -117.98 48.95 1.3 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.48 -25.65 67.58 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.101 0.477 . . . . 0.0 110.746 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -83.17 -30.0 28.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -140.14 74.41 30.55 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.49 0.662 . . . . 0.0 110.603 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.64 -7.93 22.28 Favored 'Trans proline' 0 N--CA 1.474 0.327 0 C-N-CA 122.721 2.281 . . . . 0.0 112.231 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.33 -14.81 60.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.952 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.98 -0.08 27.22 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.4 t -54.83 -35.0 32.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.109 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -54.27 42.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.12 -32.75 55.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.957 0.408 . . . . 0.0 111.182 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -75.55 -44.71 42.01 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.753 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 68.9 t -65.1 -41.81 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.233 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -52.05 -38.5 57.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.958 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -74.46 -52.75 11.1 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.053 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.4 t -54.94 -54.93 36.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.691 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -61.74 -67.64 0.39 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -68.64 -170.73 0.23 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.09 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -170.66 73.58 0.06 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.507 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -94.14 40.52 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.182 0.515 . . . . 0.0 110.823 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -172.83 -102.78 0.16 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.754 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -173.98 -42.21 0.05 OUTLIER Glycine 0 C--N 1.334 0.453 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.146 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -138.36 -135.01 3.27 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.228 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.552 0 CA-C-O 121.067 0.46 . . . . 0.0 110.794 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 112.261 -0.335 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 95.6 p -53.15 148.23 8.58 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.456 0.645 . . . . 0.0 110.973 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 146.2 -173.44 26.49 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.218 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -132.12 120.73 22.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.214 0.531 . . . . 0.0 110.906 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.1 57.88 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.526 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.8 155.69 15.64 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.679 0.276 . . . . 0.0 110.846 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 86.8 m -52.83 -35.67 57.51 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.998 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -64.09 -64.28 0.93 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.236 0.541 . . . . 0.0 111.306 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 t -56.52 -36.43 69.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.2 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -67.03 -44.57 79.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.705 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.4 m -71.63 -30.79 66.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.801 0.334 . . . . 0.0 111.192 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.8 mtm -69.32 -44.85 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.41 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -68.34 -35.56 77.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.672 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -71.79 -25.87 62.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.06 0.457 . . . . 0.0 111.505 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -118.53 49.51 1.28 Allowed 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -64.35 -26.39 68.45 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.19 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.07 -29.9 28.43 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.675 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -141.04 74.25 25.64 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.786 0.803 . . . . 0.0 110.912 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.01 -7.86 22.18 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.554 2.17 . . . . 0.0 111.899 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -75.43 -14.63 60.46 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.761 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.31 0.09 26.73 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.32 -179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.1 t -54.69 -35.4 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.829 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.78 -53.23 51.17 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.255 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.03 -32.35 61.79 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.688 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -75.76 -45.54 35.82 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.258 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.14 -40.11 87.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.231 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -53.25 -37.41 62.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -75.34 -55.81 5.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.388 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -53.96 -34.68 60.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.659 0.743 . . . . 0.0 111.337 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.08 -58.02 8.89 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.812 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.17 173.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -86.81 42.56 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 123.537 0.523 . . . . 0.0 111.029 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 ptt85 -75.14 -16.14 60.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.824 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -103.96 -131.72 7.3 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.434 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 178.73 -53.56 0.09 OUTLIER Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.434 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 84.96 141.15 5.33 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.32 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.5 t0 . . . . . 0 C--O 1.236 0.352 0 CA-C-O 120.969 0.414 . . . . 0.0 110.834 179.986 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.392 0 CA-C-O 121.096 0.275 . . . . 0.0 112.426 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -117.22 118.01 31.14 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.226 0.536 . . . . 0.0 110.83 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 163.46 -81.6 0.12 Allowed Glycine 0 CA--C 1.525 0.687 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.644 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.3 mtt-85 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.579 0.228 . . . . 0.0 111.177 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -102.64 128.42 9.54 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.263 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.2 p -67.63 -170.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.27 0.557 . . . . 0.0 110.631 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.2 m -96.6 -25.25 15.67 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.816 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -73.67 -63.9 1.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.811 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -55.65 -36.21 66.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.824 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -66.62 -46.05 77.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.992 0.425 . . . . 0.0 110.64 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -71.45 -27.87 63.56 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 mtm -69.65 -45.78 67.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.057 0.456 . . . . 0.0 110.757 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.97 -36.13 82.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.815 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ttt85 -73.44 -26.01 60.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.616 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -118.58 48.53 1.43 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.706 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -65.52 -25.58 67.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.744 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -81.99 -34.36 29.71 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.169 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -134.39 73.82 67.93 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-O 121.514 0.673 . . . . 0.0 110.633 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.0 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.333 -0.253 0 C-N-CA 123.156 2.571 . . . . 0.0 112.35 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -75.51 -13.99 60.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.65 0.42 26.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.762 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.6 t -54.69 -36.97 38.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.735 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.61 -54.82 32.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.058 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.37 -32.77 57.76 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -75.29 -44.53 45.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.082 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.9 t -65.59 -41.62 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 t -52.2 -38.17 57.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.521 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -75.02 -53.06 9.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 0.0 111.009 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.7 t -54.77 -55.25 32.05 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.415 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -59.87 -31.72 70.04 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.397 0.618 . . . . 0.0 111.286 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.07 149.62 44.65 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.08 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 14.32 7.79 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.748 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.15 25.44 4.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.25 169.81 29.57 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.592 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.05 33.74 10.55 Favored Glycine 0 CA--C 1.511 -0.212 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.382 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.39 172.11 24.88 Favored Glycine 0 N--CA 1.455 -0.092 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.714 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 120.732 0.301 . . . . 0.0 110.678 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.461 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 52.89 42.55 32.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.808 0.337 . . . . 0.0 111.147 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 103.73 40.95 2.24 Favored Glycine 0 CA--C 1.506 -0.486 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.409 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 44.87 -164.36 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.382 0 CA-C-O 121.325 0.583 . . . . 0.0 110.434 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.24 -137.05 23.25 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.337 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.4 148.46 24.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.569 0.223 . . . . 0.0 110.693 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.1 m -61.62 -27.93 69.0 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.671 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -73.95 -63.72 1.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.161 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.8 t -52.91 -35.78 58.7 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.801 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -66.25 -52.11 50.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.138 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.4 m -66.65 -25.21 66.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 52.2 mtp -72.49 -45.01 61.46 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.531 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -68.56 -35.92 78.07 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.48 -28.16 63.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -117.8 50.84 1.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.595 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.59 -26.05 67.67 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.592 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.05 -44.38 16.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -122.28 74.43 40.67 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.857 0.837 . . . . 0.0 110.952 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -70.19 -8.1 22.79 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.823 2.349 . . . . 0.0 111.959 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 1.5 m0 -75.19 -15.12 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.127 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.01 0.53 27.77 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.6 -43.79 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.246 0.546 . . . . 0.0 110.947 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -51.05 -45.68 61.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.151 0.501 . . . . 0.0 111.236 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.87 -34.76 71.97 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.408 0.623 . . . . 0.0 110.959 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.5 t -75.47 -44.42 44.19 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.138 0.494 . . . . 0.0 110.806 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.7 t -65.37 -41.42 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.045 0.45 . . . . 0.0 111.377 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.1 m -52.04 -37.98 55.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.801 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -75.95 -51.87 11.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.666 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.6 t -55.58 -54.22 46.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.088 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -60.67 -31.45 70.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.081 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -62.9 164.43 8.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.937 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.6 mtt-85 55.82 57.4 5.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.923 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -16.37 58.27 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.479 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -68.14 143.16 40.77 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.822 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 153.57 -86.26 0.14 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.658 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -106.94 145.48 15.96 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.473 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 120.59 0.233 . . . . 0.0 110.508 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.9 m -103.52 -179.78 4.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.672 0.236 . . . . 0.0 110.781 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 107.65 81.78 1.4 Allowed Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.337 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.58 62.67 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.948 0.404 . . . . 0.0 111.166 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -112.02 159.14 13.89 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.704 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p -60.49 155.71 17.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.231 0.538 . . . . 0.0 110.815 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.65 -26.3 65.4 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.475 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.39 -64.09 1.02 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.766 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -41.66 60.06 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.633 0.254 . . . . 0.0 111.135 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -65.04 -49.32 70.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.765 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.1 m -62.6 -36.45 82.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.232 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.8 mtm -64.17 -47.06 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.652 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -64.74 -36.14 83.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.805 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -74.25 -30.21 62.04 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.207 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -115.71 35.92 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.168 0.509 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.18 -25.71 65.78 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.025 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -83.01 -25.82 31.82 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.529 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -139.22 71.88 39.44 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.51 -6.68 19.05 Favored 'Trans proline' 0 C--N 1.334 -0.224 0 C-N-CA 122.532 2.155 . . . . 0.0 112.543 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -76.5 0.2 20.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.838 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -130.26 12.6 5.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 110.731 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.1 t -59.39 -39.85 80.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.653 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -51.8 63.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.982 0.42 . . . . 0.0 110.978 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.39 -32.49 57.28 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -74.81 -45.32 44.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.235 0.54 . . . . 0.0 111.045 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.08 -41.48 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.422 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -37.54 59.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.31 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -75.0 -52.2 11.71 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.442 0.639 . . . . 0.0 111.364 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -54.91 -55.35 31.54 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.958 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -35.79 76.45 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.017 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.98 126.31 24.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.935 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 62.21 71.09 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.183 0.302 . . . . 0.0 110.739 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -92.98 43.81 1.13 Allowed 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 121.19 0.519 . . . . 0.0 110.857 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -129.37 -41.46 0.25 Allowed Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.498 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.18 -21.46 71.96 Favored Glycine 0 C--O 1.226 -0.382 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.766 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 168.02 -163.52 37.22 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.714 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.3 t70 . . . . . 0 C--N 1.327 -0.406 0 CA-C-O 121.08 0.466 . . . . 0.0 110.727 179.559 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 120.448 0.166 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -64.2 -64.33 0.91 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.281 0.563 . . . . 0.0 110.943 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.16 -34.68 66.4 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.737 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -68.04 -47.46 68.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.427 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -71.19 -26.53 63.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.108 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.2 mtm -69.04 -48.62 62.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.085 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -68.2 -35.67 78.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.333 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -69.34 -27.07 65.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -118.48 49.22 1.31 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.902 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 . . . . . 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.657 -179.805 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.224 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.26 -39.45 43.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.023 0.44 . . . . 0.0 111.198 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -50.85 -48.16 60.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.002 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.74 -35.73 71.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -75.13 -43.73 51.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.247 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 73.5 t -64.77 -40.81 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-O 120.808 0.337 . . . . 0.0 111.024 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 t -57.59 -45.64 85.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.946 0.403 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.48 -49.18 19.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.431 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 44.0 t -55.19 -45.29 75.81 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.485 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -72.58 -63.81 1.08 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.839 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.7 t -55.06 -35.89 65.0 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.099 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -65.53 -47.16 76.87 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.399 0.437 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.79 -26.66 62.51 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.04 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.5 mtm -71.07 -44.76 65.07 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -36.4 82.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.489 0.661 . . . . 0.0 111.073 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -72.14 -28.58 63.34 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -117.31 49.02 1.24 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.789 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 O-C-N 123.44 0.462 . . . . 0.0 110.523 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.526 0.047 0 CA-C-O 120.331 0.11 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.0 t -55.28 -42.51 66.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 O-C-N 123.597 0.561 . . . . 0.0 110.611 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.16 -48.99 61.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.776 0.322 . . . . 0.0 110.693 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.57 -34.4 67.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.847 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.67 -43.92 45.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.75 -40.96 89.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.165 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.23 -38.44 58.02 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 121.02 0.438 . . . . 0.0 110.849 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.38 -52.37 10.93 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.599 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -54.63 -54.66 38.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.293 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 . . . . . 0 N--CA 1.454 -0.23 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.692 -179.695 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 81.4 m . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.667 0.27 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -73.78 -64.56 0.97 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.04 -38.51 65.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.823 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.35 -47.11 74.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.961 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 m -67.87 -28.34 67.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.092 0.472 . . . . 0.0 111.005 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.3 mtm -71.2 -42.82 68.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.528 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -66.62 -35.88 81.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -26.03 59.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.031 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -117.85 43.99 2.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.185 0.517 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.31 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.05 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 . . . . . 0 C--O 1.224 -0.252 0 CA-C-O 121.528 0.68 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -54.78 -44.88 73.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.249 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -51.31 -47.82 62.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.21 0.528 . . . . 0.0 111.308 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -56.62 -35.73 68.64 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.049 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 30.8 t -74.74 -45.22 45.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.28 -41.06 91.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.198 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -38.69 61.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.492 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -74.9 -52.38 11.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.18 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.63 -54.84 36.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.246 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 . . . . . 0 C--O 1.24 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.655 179.884 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.9 m . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.995 0.426 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.544 ' HD2' HG21 ' A' ' 26' ' ' VAL . 2.1 tpt180 -75.68 -63.29 1.33 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.978 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.55 -36.96 56.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.79 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -67.39 -51.77 47.89 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.379 0.424 . . . . 0.0 111.035 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 m -65.24 -25.19 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.487 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 55.8 mtp -72.39 -43.01 64.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.122 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtt-85 -66.75 -36.28 82.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.86 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -73.83 -26.27 60.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.077 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -118.04 43.82 2.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.819 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 C--O 1.235 0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -179.868 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.851 0.357 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -53.85 -45.8 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 121.363 0.602 . . . . 0.0 111.228 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -44.74 62.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.947 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.65 -35.78 73.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.39 0.614 . . . . 0.0 111.325 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.72 -44.18 43.26 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.544 HG21 ' HD2' ' A' ' 8' ' ' ARG . 72.9 t -64.0 -41.75 93.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.219 0.533 . . . . 0.0 111.277 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -38.22 59.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.059 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -74.77 -52.37 11.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.011 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.4 t -55.17 -55.05 35.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 . . . . . 0 N--CA 1.464 0.253 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.063 -179.99 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.049 0.452 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -72.44 -63.84 1.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.491 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.4 t -55.31 -37.13 66.98 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.562 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.63 -47.14 76.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 111.143 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -69.61 -28.57 66.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.296 0.57 . . . . 0.0 110.795 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.7 mtt -68.49 -46.25 70.19 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.215 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -36.2 83.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.847 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.0 -25.92 60.17 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.907 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -117.79 40.04 3.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.823 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.548 0 O-C-N 123.176 0.297 . . . . 0.0 110.421 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.343 0.592 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.7 t -56.53 -40.93 71.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.637 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -45.39 63.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.29 -35.7 72.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.089 0.471 . . . . 0.0 110.401 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.8 t -75.52 -44.57 42.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.923 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -64.21 -41.16 91.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.886 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.4 t -52.5 -38.12 58.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.311 0.576 . . . . 0.0 110.935 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -75.0 -53.07 9.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.755 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -54.68 -55.06 33.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.015 -179.915 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.456 -0.156 0 CA-C-O 121.041 0.448 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -65.27 -63.72 1.03 Allowed 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.982 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -40.3 64.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -66.14 -47.97 72.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.575 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 m -64.67 -33.28 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.791 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtm -66.77 -44.42 81.4 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.581 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -66.81 -36.02 81.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.916 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -74.02 -27.82 61.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.793 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -118.24 35.53 4.71 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.465 0.478 . . . . 0.0 110.577 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 . . . . . 0 C--N 1.327 -0.387 0 O-C-N 123.458 0.474 . . . . 0.0 110.626 179.994 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 . . . . . 0 N--CA 1.463 0.204 0 CA-C-O 120.544 0.211 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -59.81 -42.08 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.649 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -51.74 -48.47 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.338 0.399 . . . . 0.0 110.789 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.52 -35.28 63.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.095 0.474 . . . . 0.0 111.081 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.0 t -75.62 -45.55 36.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.339 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.66 -40.19 87.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.389 0.614 . . . . 0.0 111.533 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.02 -42.24 80.01 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.067 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.22 -52.42 10.94 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.565 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.8 t -54.0 -43.76 70.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.786 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.8 m . . . . . 0 C--O 1.24 0.581 0 CA-C-O 120.643 0.259 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.6 -63.89 1.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.919 0.39 . . . . 0.0 111.209 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -54.89 -36.84 65.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.799 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -65.76 -45.93 80.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.865 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.28 -26.42 61.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.691 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 mtm -71.84 -44.78 63.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.899 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -67.45 -36.29 80.9 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.018 0.437 . . . . 0.0 110.74 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -72.12 -26.11 62.0 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.906 0.384 . . . . 0.0 111.174 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.91 49.13 1.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.869 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 C--N 1.323 -0.547 0 O-C-N 123.547 0.53 . . . . 0.0 111.055 -179.924 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.874 0.368 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.35 -42.23 56.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.429 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -50.79 -48.52 59.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.136 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.16 -34.94 68.96 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.595 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 t -74.8 -44.82 47.37 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.064 0.459 . . . . 0.0 110.735 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.4 t -64.82 -41.78 93.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.088 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.33 -38.02 57.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.116 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -74.91 -52.89 10.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.1 t -54.96 -54.24 45.43 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.433 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 . . . . . 0 CA--C 1.534 0.333 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.527 -179.8 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.7 m . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.985 0.421 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -73.38 -64.17 1.04 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.028 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -55.38 -36.06 65.96 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -65.62 -46.07 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.263 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -73.02 -25.44 60.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.567 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.2 mtm -71.76 -45.23 62.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.203 0.525 . . . . 0.0 111.085 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmm-85 -68.13 -34.96 77.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -72.24 -27.04 62.26 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.759 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.74 49.77 1.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.345 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.45 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.3 t -54.49 -42.22 58.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.009 0.433 . . . . 0.0 111.399 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -51.17 -48.12 61.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.954 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.32 -34.63 68.93 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.794 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.2 t -75.38 -44.33 45.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.264 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.85 -41.37 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.358 0.599 . . . . 0.0 111.45 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -55.29 -39.82 70.32 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.805 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -75.03 -51.17 14.23 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.0 0.429 . . . . 0.0 111.071 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.2 t -55.3 -54.31 45.13 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.8 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 . . . . . 0 C--N 1.328 -0.357 0 CA-C-O 121.096 0.474 . . . . 0.0 110.793 -179.828 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.2 m . . . . . 0 C--O 1.234 0.258 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -64.45 -63.99 0.99 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -57.36 -36.01 70.67 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.52 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -67.84 -43.83 78.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.68 -31.15 64.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.742 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.2 mtm -67.49 -46.96 71.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.569 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -65.72 -35.57 81.11 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.136 0.493 . . . . 0.0 111.215 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -73.07 -25.64 60.97 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -119.13 49.48 1.33 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.498 0.499 . . . . 0.0 110.989 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.032 -179.687 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -54.16 -35.9 30.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.105 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -54.34 43.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.54 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -55.03 -32.56 61.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.3 t -75.35 -44.65 43.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.01 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -65.48 -40.6 88.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.722 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -56.88 -42.48 79.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 110.526 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -75.22 -52.44 10.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.816 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.1 t -55.05 -42.74 73.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.43 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m . . . . . 0 C--O 1.235 0.303 0 CA-C-O 121.4 0.619 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -64.5 0.85 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.8 t -55.61 -34.08 64.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.184 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -65.2 -46.16 81.82 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.902 0.382 . . . . 0.0 110.715 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.5 m -75.99 -25.94 56.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 41.3 mtp -63.88 -55.4 23.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.831 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -65.15 -38.72 91.5 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.56 0.537 . . . . 0.0 110.882 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 -63.94 -25.43 68.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 110.919 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -120.38 50.2 1.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.81 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.946 -179.88 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.763 0.316 . . . . 0.0 111.085 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.0 t -54.39 -38.22 39.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.085 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -55.21 28.16 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.639 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.22 -32.63 56.36 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.654 0.596 . . . . 0.0 111.141 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.8 t -75.37 -45.19 40.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.646 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.95 -42.12 93.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.995 0.426 . . . . 0.0 110.996 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.6 t -51.29 -38.46 52.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.353 0.597 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.51 -52.46 10.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.676 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.4 t -54.89 -55.11 34.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.788 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 110.785 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.22 -64.26 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.723 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.3 t -57.6 -34.46 69.28 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.108 0.48 . . . . 0.0 110.636 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -68.77 -44.8 72.91 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.63 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -71.6 -32.0 67.54 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.389 0.614 . . . . 0.0 111.02 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 mtm -67.85 -46.52 71.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -65.98 -35.77 81.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.862 0.363 . . . . 0.0 111.099 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ttt85 -71.76 -28.29 63.54 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.52 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -117.51 50.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.139 0.495 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.607 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.9 t -54.05 -41.65 51.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.517 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.76 -48.07 63.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.124 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.96 -35.73 69.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.547 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -74.89 -44.52 48.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.646 0.26 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.3 -40.24 87.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.046 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t -57.56 -46.83 83.46 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.038 0.447 . . . . 0.0 110.773 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.33 -49.42 19.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.9 t -54.52 -46.31 73.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.726 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.803 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 121.086 0.469 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -64.54 1.02 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -54.4 -37.87 65.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.937 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -66.84 -47.1 73.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.114 0.483 . . . . 0.0 110.806 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.1 m -67.12 -35.23 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.7 mtm -65.57 -41.48 92.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.502 0.668 . . . . 0.0 111.142 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.5 -39.11 93.18 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.682 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -74.58 -26.72 60.12 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.01 0.434 . . . . 0.0 110.633 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -117.31 45.48 1.89 Allowed 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.951 179.933 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.569 0.223 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.22 -44.78 66.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.932 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -53.65 46.37 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.561 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -55.16 -32.73 62.36 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.041 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -74.74 -45.18 45.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.145 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.16 -41.38 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-O 121.676 0.751 . . . . 0.0 111.279 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -38.19 58.82 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.698 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -75.53 -51.87 11.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.906 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.6 t -54.85 -55.51 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.392 0.615 . . . . 0.0 110.996 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.808 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.8 m . . . . . 0 C--O 1.238 0.47 0 CA-C-O 120.75 0.31 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -64.7 0.94 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.889 0.376 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -53.65 -38.1 63.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.631 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -65.82 -48.33 72.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.4 m -67.9 -29.48 68.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.0 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.75 -47.11 70.19 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.223 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -65.11 -35.88 82.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -73.13 -27.12 61.5 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.953 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -117.93 41.18 2.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.921 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.803 0.335 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.5 t -57.97 -40.73 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 121.044 0.449 . . . . 0.0 111.367 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -51.4 -48.43 62.62 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.624 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -56.2 -34.69 66.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.943 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -75.06 -44.16 49.16 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.266 0.555 . . . . 0.0 111.132 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -64.9 -41.71 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.805 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.0 t -52.01 -37.71 54.32 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.442 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -74.95 -52.71 10.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.394 0.616 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.43 -55.77 25.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.862 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.868 179.981 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.5 m . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 121.12 0.486 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -73.49 -63.77 1.13 Allowed 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.931 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -54.43 -38.03 65.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.224 0.535 . . . . 0.0 110.778 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -64.41 -47.07 80.56 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.736 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.458 ' HB3' HG13 ' A' ' 22' ' ' VAL . 52.1 m -71.42 -24.8 62.1 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.747 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 17.4 mtm -72.99 -43.68 61.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.218 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -68.74 -35.9 77.7 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.672 0.607 . . . . 0.0 111.032 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -71.6 -28.65 63.95 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.595 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -117.72 48.31 1.4 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.054 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 . . . . . 0 CA--C 1.517 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.034 -179.904 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 121.052 0.453 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 11' ' ' CYS . 25.4 t -55.53 -34.06 34.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.068 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.35 -55.84 24.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.7 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.03 -31.35 61.01 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.576 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.7 t -75.7 -44.95 39.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.974 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.6 t -65.17 -41.13 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.57 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.4 t -52.49 -37.9 58.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.865 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.2 -52.67 10.36 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.834 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.3 t -54.6 -55.18 32.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.028 0.442 . . . . 0.0 110.634 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 . . . . . 0 N--CA 1.461 0.104 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 -179.515 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m . . . . . 0 C--O 1.239 0.505 0 CA-C-O 120.58 0.229 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.12 -63.83 1.1 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.924 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.9 m -53.39 -39.34 64.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.057 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.98 -48.05 80.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.983 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB3' HG13 ' A' ' 22' ' ' VAL . 50.6 m -70.84 -24.9 62.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.707 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.9 mtm -72.63 -44.17 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.886 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -69.1 -35.25 76.25 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.772 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -72.01 -28.75 63.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.643 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -117.42 48.51 1.34 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.795 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.66 0.267 . . . . 0.0 110.894 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.461 HG13 ' HB3' ' A' ' 11' ' ' CYS . 27.7 t -55.03 -34.74 32.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -55.09 34.85 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.701 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -54.83 -31.9 59.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.522 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.8 t -75.98 -44.4 39.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 123.589 0.556 . . . . 0.0 111.062 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -65.6 -41.31 90.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.909 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -37.67 57.79 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -75.23 -52.58 10.56 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.325 0.583 . . . . 0.0 111.186 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -55.07 -54.89 37.35 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.955 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ttm180 . . . . . 0 C--O 1.235 0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.921 179.826 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.2 m . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HD3' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -74.26 -64.32 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.202 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 t -52.13 -36.49 51.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.063 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -67.29 -51.43 52.83 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.127 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB3' HG13 ' A' ' 22' ' ' VAL . 51.2 m -64.51 -29.01 70.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.9 mtp -68.92 -47.19 66.37 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.806 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -65.62 -36.41 83.64 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.676 0.61 . . . . 0.0 110.94 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ttt-85 -71.82 -26.26 62.32 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -117.98 48.95 1.3 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.239 0.507 0 CA-C-O 121.101 0.477 . . . . 0.0 110.746 -179.494 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.794 0.331 . . . . 0.0 110.805 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 11' ' ' CYS . 28.4 t -54.83 -35.0 32.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -54.27 42.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.12 -32.75 55.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.957 0.408 . . . . 0.0 111.182 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -75.55 -44.71 42.01 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.753 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.55 HG21 ' HD3' ' A' ' 8' ' ' ARG . 68.9 t -65.1 -41.81 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.233 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -52.05 -38.5 57.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.958 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -74.46 -52.75 11.1 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.053 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.4 t -54.94 -54.93 36.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.691 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 -179.819 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 86.8 m . . . . . 0 C--O 1.236 0.362 0 CA-C-O 120.976 0.417 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -64.09 -64.28 0.93 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.236 0.541 . . . . 0.0 111.306 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 t -56.52 -36.43 69.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.2 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -67.03 -44.57 79.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.705 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.527 ' HB3' HG13 ' A' ' 22' ' ' VAL . 44.4 m -71.63 -30.79 66.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.801 0.334 . . . . 0.0 111.192 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.8 mtm -69.32 -44.85 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.41 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -68.34 -35.56 77.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.672 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -71.79 -25.87 62.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.06 0.457 . . . . 0.0 111.505 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -118.53 49.51 1.28 Allowed 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.19 179.798 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.475 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.527 HG13 ' HB3' ' A' ' 11' ' ' CYS . 28.1 t -54.69 -35.4 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.829 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.78 -53.23 51.17 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.255 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.03 -32.35 61.79 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.688 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -75.76 -45.54 35.82 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.258 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.14 -40.11 87.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.231 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -53.25 -37.41 62.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -75.34 -55.81 5.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.388 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -53.96 -34.68 60.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.659 0.743 . . . . 0.0 111.337 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.238 0.483 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.812 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.2 m . . . . . 0 C--O 1.237 0.413 0 CA-C-O 120.663 0.268 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.543 ' HD3' HG21 ' A' ' 26' ' ' VAL . 2.1 tpp180 -73.67 -63.9 1.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.811 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -55.65 -36.21 66.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.824 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -66.62 -46.05 77.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.992 0.425 . . . . 0.0 110.64 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -71.45 -27.87 63.56 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 mtm -69.65 -45.78 67.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.057 0.456 . . . . 0.0 110.757 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.97 -36.13 82.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.815 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ttt85 -73.44 -26.01 60.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.616 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -118.58 48.53 1.43 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.706 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.744 -179.354 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 120.784 0.326 . . . . 0.0 110.762 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.6 t -54.69 -36.97 38.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.735 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.61 -54.82 32.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.058 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.37 -32.77 57.76 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -75.29 -44.53 45.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.082 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.543 HG21 ' HD3' ' A' ' 8' ' ' ARG . 69.9 t -65.59 -41.62 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 t -52.2 -38.17 57.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.521 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -75.02 -53.06 9.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 0.0 111.009 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.7 t -54.77 -55.25 32.05 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.415 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 . . . . . 0 N--CA 1.448 -0.558 0 CA-C-O 121.397 0.618 . . . . 0.0 111.286 -179.93 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.1 m . . . . . 0 C--O 1.236 0.361 0 CA-C-O 120.782 0.325 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -73.95 -63.72 1.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.161 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.8 t -52.91 -35.78 58.7 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.801 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -66.25 -52.11 50.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.138 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.4 m -66.65 -25.21 66.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 52.2 mtp -72.49 -45.01 61.46 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.531 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -68.56 -35.92 78.07 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.48 -28.16 63.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -117.8 50.84 1.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.595 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.592 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.338 0 CA-C-O 121.096 0.474 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.6 -43.79 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.246 0.546 . . . . 0.0 110.947 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -51.05 -45.68 61.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.151 0.501 . . . . 0.0 111.236 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.87 -34.76 71.97 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.408 0.623 . . . . 0.0 110.959 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.5 t -75.47 -44.42 44.19 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.138 0.494 . . . . 0.0 110.806 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.7 t -65.37 -41.42 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.045 0.45 . . . . 0.0 111.377 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.1 m -52.04 -37.98 55.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.801 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -75.95 -51.87 11.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.666 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.6 t -55.58 -54.22 46.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.088 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.081 179.655 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--O 1.24 0.601 0 CA-C-O 120.809 0.338 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.39 -64.09 1.02 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.766 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -41.66 60.06 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.633 0.254 . . . . 0.0 111.135 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -65.04 -49.32 70.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.765 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.1 m -62.6 -36.45 82.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.232 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.8 mtm -64.17 -47.06 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.652 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -64.74 -36.14 83.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.805 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -74.25 -30.21 62.04 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.207 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -115.71 35.92 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.168 0.509 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 . . . . . 0 C--O 1.221 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.025 179.958 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.921 0.391 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.1 t -59.39 -39.85 80.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.653 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -51.8 63.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.982 0.42 . . . . 0.0 110.978 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.39 -32.49 57.28 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -74.81 -45.32 44.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.235 0.54 . . . . 0.0 111.045 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.08 -41.48 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.422 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -37.54 59.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.31 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -75.0 -52.2 11.71 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.442 0.639 . . . . 0.0 111.364 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -54.91 -55.35 31.54 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.958 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.017 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m 61.86 32.59 17.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.926 0.393 . . . . 0.0 110.992 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.84 173.8 0.78 Allowed Glycine 0 C--O 1.228 -0.247 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.867 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.08 168.69 9.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.006 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.5 77.16 1.24 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.379 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.43 145.52 21.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.547 0.213 . . . . 0.0 111.412 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.8 m -59.29 -27.68 66.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.882 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -64.2 -64.33 0.91 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.281 0.563 . . . . 0.0 110.943 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.16 -34.68 66.4 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.737 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -68.04 -47.46 68.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.427 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -71.19 -26.53 63.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.108 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.2 mtm -69.04 -48.62 62.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.085 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -68.2 -35.67 78.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.333 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -69.34 -27.07 65.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -118.48 49.22 1.31 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.902 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.17 -26.5 68.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.657 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -81.66 -25.72 35.35 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.208 0.528 . . . . 0.0 111.317 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -145.63 75.57 13.31 Favored Pre-proline 0 C--O 1.236 0.392 0 CA-C-O 121.881 0.848 . . . . 0.0 111.151 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.696 ' HA ' HG23 ' A' ' 22' ' ' VAL . 54.4 Cg_endo -69.5 -7.59 21.39 Favored 'Trans proline' 0 C--O 1.22 -0.38 0 C-N-CA 122.89 2.393 . . . . 0.0 112.567 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.1 m95 -75.95 -14.76 60.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.711 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.57 0.49 26.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.521 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.696 HG23 ' HA ' ' A' ' 19' ' ' PRO . 31.0 t -54.26 -39.45 43.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.023 0.44 . . . . 0.0 111.198 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -50.85 -48.16 60.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.002 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.74 -35.73 71.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -75.13 -43.73 51.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.247 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 73.5 t -64.77 -40.81 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-O 120.808 0.337 . . . . 0.0 111.024 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 t -57.59 -45.64 85.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.946 0.403 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.48 -49.18 19.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.431 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 44.0 t -55.19 -45.29 75.81 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -63.74 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -54.41 155.4 3.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.857 0.361 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 53.04 59.0 4.75 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.699 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.5 ptt-85 -87.12 -16.28 35.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.974 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.77 -29.15 71.28 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.218 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.41 48.12 0.01 OUTLIER Glycine 0 CA--C 1.516 0.134 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.037 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.59 168.62 21.83 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.737 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.435 0.117 . . . . 0.0 111.276 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 N-CA-C 112.529 -0.228 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m 51.98 53.43 12.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.277 0.56 . . . . 0.0 111.072 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 101.31 27.6 7.19 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.548 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.92 -173.83 0.11 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.156 0.503 . . . . 0.0 111.124 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -153.92 103.85 0.24 Allowed Glycine 0 C--N 1.334 0.443 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.62 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.08 141.34 52.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.004 0.431 . . . . 0.0 110.977 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -53.88 -28.67 37.7 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.953 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -72.58 -63.81 1.08 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.839 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.7 t -55.06 -35.89 65.0 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.099 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -65.53 -47.16 76.87 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.399 0.437 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.79 -26.66 62.51 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.04 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.5 mtm -71.07 -44.76 65.07 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -36.4 82.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.489 0.661 . . . . 0.0 111.073 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -72.14 -28.58 63.34 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -117.31 49.02 1.24 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.789 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -26.87 68.72 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 123.44 0.462 . . . . 0.0 110.523 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.95 -46.89 13.4 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -118.2 74.02 10.46 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 121.796 0.808 . . . . 0.0 111.484 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.691 ' HA ' HG23 ' A' ' 22' ' ' VAL . 50.2 Cg_endo -69.9 -7.44 21.11 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.003 2.469 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.46 -14.05 60.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.89 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.36 0.27 26.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.974 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.691 HG23 ' HA ' ' A' ' 19' ' ' PRO . 29.0 t -55.28 -42.51 66.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 O-C-N 123.597 0.561 . . . . 0.0 110.611 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.16 -48.99 61.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.776 0.322 . . . . 0.0 110.693 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.57 -34.4 67.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.847 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.67 -43.92 45.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.75 -40.96 89.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.165 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.23 -38.44 58.02 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 121.02 0.438 . . . . 0.0 110.849 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.38 -52.37 10.93 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.599 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -54.63 -54.66 38.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.293 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -61.12 -30.12 70.18 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.692 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -65.16 98.59 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.268 0.556 . . . . 0.0 110.609 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -88.09 42.97 1.09 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.682 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -15.95 27.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.678 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.43 -68.89 1.5 Allowed Glycine 0 C--O 1.239 0.439 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.33 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 55.94 27.42 Favored Glycine 0 C--N 1.319 -0.384 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.27 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -157.58 -173.79 26.46 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.673 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.7 t70 . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.849 0.357 . . . . 0.0 110.878 179.819 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.376 -0.29 . . . . 0.0 112.376 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.0 m 54.84 71.37 0.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.791 0.329 . . . . 0.0 111.045 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 164.58 143.29 3.66 Favored Glycine 0 C--O 1.238 0.376 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.19 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.39 139.71 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.866 0.365 . . . . 0.0 110.693 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -131.87 129.68 5.7 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.423 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.8 p -62.24 146.72 50.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 110.897 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 81.4 m -56.72 -26.39 56.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -73.78 -64.56 0.97 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.04 -38.51 65.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.823 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.35 -47.11 74.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.961 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 m -67.87 -28.34 67.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.092 0.472 . . . . 0.0 111.005 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.3 mtm -71.2 -42.82 68.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.528 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -66.62 -35.88 81.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -26.03 59.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.031 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -117.85 43.99 2.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.185 0.517 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.04 -26.1 68.12 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.05 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -87.6 -26.68 22.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.073 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -139.72 69.88 37.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.806 0.812 . . . . 0.0 110.599 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.759 ' HA ' HG23 ' A' ' 22' ' ' VAL . 52.4 Cg_endo -69.78 -5.84 17.17 Favored 'Trans proline' 0 N--CA 1.475 0.384 0 C-N-CA 122.611 2.208 . . . . 0.0 112.343 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -71.2 -17.77 62.51 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.433 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -106.13 8.58 32.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.528 0.68 . . . . 0.0 111.166 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.759 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.1 t -54.78 -44.88 73.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -51.31 -47.82 62.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.21 0.528 . . . . 0.0 111.308 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -56.62 -35.73 68.64 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.049 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 30.8 t -74.74 -45.22 45.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.28 -41.06 91.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.198 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -38.69 61.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.492 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -74.9 -52.38 11.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.18 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.63 -54.84 36.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.246 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -61.61 -67.16 0.44 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.655 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.86 93.4 0.55 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.816 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptp85 -87.95 43.1 1.09 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.827 0.346 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.63 -16.49 60.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.343 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -88.66 -123.55 2.14 Favored Glycine 0 CA--C 1.509 -0.316 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.822 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -147.64 -116.73 0.93 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.617 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -59.12 143.56 45.76 Favored Glycine 0 CA--C 1.508 -0.404 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.532 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.325 -0.496 0 O-C-N 122.665 -0.315 . . . . 0.0 110.755 -179.859 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.432 0 N-CA-C 112.259 -0.336 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.1 m -89.28 -70.08 0.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.961 0.41 . . . . 0.0 111.171 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.57 -96.69 0.12 Allowed Glycine 0 C--O 1.229 -0.164 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.332 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.68 175.42 5.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.586 0.193 . . . . 0.0 111.07 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.66 136.26 0.05 OUTLIER Glycine 0 CA--C 1.526 0.77 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.403 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -75.33 -177.35 3.49 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 120.865 0.364 . . . . 0.0 110.67 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.9 m -63.66 -16.33 60.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.095 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.544 ' HD2' HG21 ' A' ' 26' ' ' VAL . 2.1 tpt180 -75.68 -63.29 1.33 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.978 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.55 -36.96 56.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.79 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -67.39 -51.77 47.89 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.379 0.424 . . . . 0.0 111.035 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 m -65.24 -25.19 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.487 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 55.8 mtp -72.39 -43.01 64.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.122 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtt-85 -66.75 -36.28 82.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.86 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -73.83 -26.27 60.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.077 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -118.04 43.82 2.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.819 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -65.67 -25.15 67.21 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -87.96 -26.07 22.86 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 121.196 0.522 . . . . 0.0 110.676 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -140.76 69.62 30.41 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 122.284 1.04 . . . . 0.0 111.31 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.766 ' HA ' HG23 ' A' ' 22' ' ' VAL . 53.9 Cg_endo -69.28 -5.46 15.96 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.697 2.265 . . . . 0.0 112.225 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -71.68 -18.17 62.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.481 0.488 . . . . 0.0 111.08 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -105.75 8.24 32.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.663 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.766 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.5 t -53.85 -45.8 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 121.363 0.602 . . . . 0.0 111.228 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -44.74 62.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.947 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.65 -35.78 73.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.39 0.614 . . . . 0.0 111.325 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.72 -44.18 43.26 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.544 HG21 ' HD2' ' A' ' 8' ' ' ARG . 72.9 t -64.0 -41.75 93.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.219 0.533 . . . . 0.0 111.277 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -38.22 59.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.059 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -74.77 -52.37 11.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.011 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.4 t -55.17 -55.05 35.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 -59.99 -64.73 0.84 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.063 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -65.85 178.75 1.0 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.363 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 mtt85 52.67 47.61 24.31 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.971 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -95.26 24.83 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.045 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -88.89 -38.74 6.77 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.331 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.2 -52.38 0.53 Allowed Glycine 0 C--O 1.226 -0.362 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.45 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 139.61 -144.96 15.84 Favored Glycine 0 C--O 1.222 -0.648 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.944 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.408 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.535 0 N-CA-C 112.321 -0.311 . . . . 0.0 112.321 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.62 166.21 12.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.405 0.621 . . . . 0.0 111.004 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.75 -114.31 0.74 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.756 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -103.88 168.88 8.84 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.693 0.282 . . . . 0.0 110.829 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -174.06 158.5 27.28 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.899 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.2 144.21 20.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.599 -0.354 . . . . 0.0 110.796 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -59.72 -26.11 65.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.221 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -72.44 -63.84 1.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.491 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.4 t -55.31 -37.13 66.98 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.562 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.63 -47.14 76.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 111.143 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -69.61 -28.57 66.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.296 0.57 . . . . 0.0 110.795 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.7 mtt -68.49 -46.25 70.19 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.215 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -36.2 83.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.847 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.0 -25.92 60.17 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.907 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -117.79 40.04 3.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.823 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.48 68.32 Favored 'General case' 0 C--O 1.239 0.548 0 O-C-N 123.176 0.297 . . . . 0.0 110.421 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -85.31 -25.97 26.86 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.327 0.392 . . . . 0.0 110.708 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -139.88 70.66 36.15 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 121.722 0.772 . . . . 0.0 111.232 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.674 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.7 Cg_endo -69.53 -7.0 19.85 Favored 'Trans proline' 0 N--CA 1.475 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.232 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -79.08 10.18 3.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.656 0.265 . . . . 0.0 111.065 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -137.19 7.58 2.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.343 0.592 . . . . 0.0 110.952 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.674 HG23 ' HA ' ' A' ' 19' ' ' PRO . 51.7 t -56.53 -40.93 71.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.637 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -45.39 63.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.29 -35.7 72.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.089 0.471 . . . . 0.0 110.401 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.8 t -75.52 -44.57 42.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.923 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -64.21 -41.16 91.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.886 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.4 t -52.5 -38.12 58.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.311 0.576 . . . . 0.0 110.935 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -75.0 -53.07 9.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.755 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -54.68 -55.06 33.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -60.17 -30.4 69.3 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.015 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 159.09 24.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.553 0.692 . . . . 0.0 110.221 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.62 3.93 34.64 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.296 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.47 -16.71 25.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.68 -109.08 0.2 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.327 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.93 -61.24 0.09 OUTLIER Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.841 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.37 132.16 7.49 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.224 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.0 t0 . . . . . 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 110.607 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.464 0 N-CA-C 112.379 -0.288 . . . . 0.0 112.379 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.46 179.32 7.44 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 120.955 0.407 . . . . 0.0 111.139 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.97 -171.17 47.75 Favored Glycine 0 N--CA 1.458 0.154 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.335 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -150.72 72.75 1.09 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.664 0.268 . . . . 0.0 111.176 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.82 115.86 0.34 Allowed Glycine 0 CA--C 1.511 -0.205 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.336 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -72.89 158.79 34.84 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.393 -0.475 . . . . 0.0 110.62 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.3 m -58.93 -31.34 68.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.927 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -65.27 -63.72 1.03 Allowed 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.982 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -40.3 64.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -66.14 -47.97 72.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.575 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 m -64.67 -33.28 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.791 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtm -66.77 -44.42 81.4 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.581 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -66.81 -36.02 81.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.916 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -74.02 -27.82 61.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.793 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -118.24 35.53 4.71 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.465 0.478 . . . . 0.0 110.577 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -60.14 -26.41 66.26 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.458 0.474 . . . . 0.0 110.626 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -83.7 -25.87 30.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.03 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -139.32 71.49 39.24 Favored Pre-proline 0 N--CA 1.455 -0.208 0 CA-C-O 121.765 0.793 . . . . 0.0 111.07 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.78 ' HA ' HG23 ' A' ' 22' ' ' VAL . 50.2 Cg_endo -70.31 -4.97 15.48 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.033 2.489 . . . . 0.0 112.114 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -76.01 -0.61 22.28 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.604 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -129.61 12.94 5.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.692 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.78 HG23 ' HA ' ' A' ' 19' ' ' PRO . 24.4 t -59.81 -42.08 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.649 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -51.74 -48.47 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.338 0.399 . . . . 0.0 110.789 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.52 -35.28 63.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.095 0.474 . . . . 0.0 111.081 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.0 t -75.62 -45.55 36.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.339 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.66 -40.19 87.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.389 0.614 . . . . 0.0 111.533 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.02 -42.24 80.01 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.067 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.22 -52.42 10.94 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.565 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.8 t -54.0 -43.76 70.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -64.9 -64.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.786 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -54.81 137.9 43.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.141 0.496 . . . . 0.0 110.65 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -85.37 3.88 37.84 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.671 0.748 . . . . 0.0 111.222 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -94.51 41.13 1.09 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.924 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -108.07 -75.39 0.9 Allowed Glycine 0 CA--C 1.509 -0.317 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.205 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 148.05 -60.32 0.45 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.645 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 141.16 -178.91 19.88 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.339 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 121.143 0.497 . . . . 0.0 110.482 -179.67 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.299 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -73.69 157.12 37.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.93 0.395 . . . . 0.0 110.95 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.59 -174.19 45.83 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.665 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 53.27 75.24 0.26 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.909 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -106.63 -87.23 1.94 Allowed Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.266 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.35 148.81 25.06 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 122.306 -0.526 . . . . 0.0 111.167 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.8 m -56.82 -27.67 60.38 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 120.643 0.259 . . . . 0.0 110.307 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.6 -63.89 1.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.919 0.39 . . . . 0.0 111.209 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -54.89 -36.84 65.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.799 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -65.76 -45.93 80.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.865 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.28 -26.42 61.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.691 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 mtm -71.84 -44.78 63.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.899 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -67.45 -36.29 80.9 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.018 0.437 . . . . 0.0 110.74 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -72.12 -26.11 62.0 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.906 0.384 . . . . 0.0 111.174 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.91 49.13 1.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.869 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.7 -26.28 68.31 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.547 0.53 . . . . 0.0 111.055 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -82.46 -40.04 21.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -127.17 74.31 77.09 Favored Pre-proline 0 C--N 1.329 -0.289 0 O-C-N 123.788 0.68 . . . . 0.0 110.91 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.704 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.8 Cg_endo -69.68 -8.09 22.7 Favored 'Trans proline' 0 C--N 1.337 -0.072 0 C-N-CA 122.921 2.414 . . . . 0.0 112.27 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -14.22 60.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.048 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.23 0.03 26.85 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.568 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 19' ' ' PRO . 31.0 t -54.35 -42.23 56.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.429 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -50.79 -48.52 59.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.136 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.16 -34.94 68.96 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.595 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 t -74.8 -44.82 47.37 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.064 0.459 . . . . 0.0 110.735 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.4 t -64.82 -41.78 93.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.088 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.33 -38.02 57.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.116 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -74.91 -52.89 10.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.1 t -54.96 -54.24 45.43 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.433 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -60.95 -65.67 0.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.527 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -65.59 108.38 2.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.011 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -86.69 13.58 8.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.024 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.82 13.93 1.91 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.677 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -102.95 -19.94 12.16 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.396 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -152.18 -63.76 0.01 OUTLIER Glycine 0 C--O 1.226 -0.403 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.14 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 150.2 171.18 18.31 Favored Glycine 0 C--O 1.238 0.386 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.724 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.988 0.423 . . . . 0.0 110.836 179.874 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.454 0 CA-C-O 120.904 0.169 . . . . 0.0 112.836 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 t 61.92 -177.75 0.13 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 122.053 -0.675 . . . . 0.0 110.741 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 100.77 72.47 0.99 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.312 -0.471 . . . . 0.0 112.403 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 45.23 -164.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.861 -0.2 . . . . 0.0 111.051 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -174.66 121.26 0.82 Allowed Glycine 0 C--O 1.23 -0.124 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.277 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -75.4 -177.55 3.62 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.91 0.386 . . . . 0.0 110.707 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.7 m -63.37 -16.52 60.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.865 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -73.38 -64.17 1.04 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.028 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -55.38 -36.06 65.96 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -65.62 -46.07 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.263 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -73.02 -25.44 60.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.567 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.2 mtm -71.76 -45.23 62.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.203 0.525 . . . . 0.0 111.085 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmm-85 -68.13 -34.96 77.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -72.24 -27.04 62.26 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.759 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.74 49.77 1.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.32 -26.64 68.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.345 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -82.14 -39.64 22.98 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -127.3 74.77 77.38 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-O 121.744 0.783 . . . . 0.0 111.002 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.695 ' HA ' HG23 ' A' ' 22' ' ' VAL . 47.7 Cg_endo -70.39 -7.4 21.15 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.746 2.297 . . . . 0.0 112.067 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 9.8 t-105 -75.82 -14.84 60.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.425 0.631 . . . . 0.0 111.005 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.35 0.32 26.88 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.398 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.695 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.3 t -54.49 -42.22 58.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.009 0.433 . . . . 0.0 111.399 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -51.17 -48.12 61.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.954 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.32 -34.63 68.93 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.794 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.2 t -75.38 -44.33 45.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.264 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.85 -41.37 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.358 0.599 . . . . 0.0 111.45 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -55.29 -39.82 70.32 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.805 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -75.03 -51.17 14.23 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.0 0.429 . . . . 0.0 111.071 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.2 t -55.3 -54.31 45.13 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.8 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 -61.7 -32.36 72.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.096 0.474 . . . . 0.0 110.793 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 143.56 50.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.712 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 62.17 55.46 2.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.039 0.447 . . . . 0.0 110.563 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -94.8 38.47 1.12 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.857 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.1 -41.33 1.08 Allowed Glycine 0 C--O 1.236 0.241 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.226 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.42 -101.12 0.01 OUTLIER Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.195 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -88.26 -144.26 9.62 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.501 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.3 t0 . . . . . 0 C--N 1.332 -0.17 0 CA-C-O 120.872 0.368 . . . . 0.0 111.065 179.871 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 N-CA-C 112.826 -0.11 . . . . 0.0 112.826 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.9 p -159.86 163.7 34.18 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 121.05 0.452 . . . . 0.0 111.067 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 149.76 144.85 4.02 Favored Glycine 0 C--O 1.221 -0.718 0 C-N-CA 121.247 -0.501 . . . . 0.0 112.466 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 60.39 99.74 0.03 OUTLIER 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.795 0.331 . . . . 0.0 111.012 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -127.95 115.18 2.03 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.763 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.48 143.36 19.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.98 0.419 . . . . 0.0 111.024 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.2 m -57.33 -27.76 62.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -64.45 -63.99 0.99 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -57.36 -36.01 70.67 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.52 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -67.84 -43.83 78.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.68 -31.15 64.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.742 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.2 mtm -67.49 -46.96 71.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.569 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -65.72 -35.57 81.11 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.136 0.493 . . . . 0.0 111.215 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -73.07 -25.64 60.97 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -119.13 49.48 1.33 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.498 0.499 . . . . 0.0 110.989 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -65.36 -25.94 67.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.032 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -82.29 -34.97 28.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.927 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.55 73.36 72.9 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.692 0.758 . . . . 0.0 110.68 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.692 ' HA ' HG23 ' A' ' 22' ' ' VAL . 54.0 Cg_endo -69.67 -7.76 21.86 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.94 2.427 . . . . 0.0 112.15 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -75.45 -15.1 60.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.237 0.541 . . . . 0.0 110.972 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.66 -0.87 27.07 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.692 HG23 ' HA ' ' A' ' 19' ' ' PRO . 35.4 t -54.16 -35.9 30.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.105 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -54.34 43.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.54 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -55.03 -32.56 61.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.3 t -75.35 -44.65 43.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.01 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -65.48 -40.6 88.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.722 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -56.88 -42.48 79.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 110.526 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -75.22 -52.44 10.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.816 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.1 t -55.05 -42.74 73.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.43 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -62.54 1.48 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -54.76 139.34 39.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.901 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 mtt85 60.53 58.29 2.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.737 0.303 . . . . 0.0 111.002 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.97 42.23 1.1 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.125 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.85 -126.94 1.28 Allowed Glycine 0 N--CA 1.459 0.214 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.469 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -84.57 -73.41 1.27 Allowed Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.418 -179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.5 -135.42 12.15 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.551 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.659 0.266 . . . . 0.0 110.825 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 112.755 -0.138 . . . . 0.0 112.755 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.5 m 61.49 85.48 0.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.819 0.343 . . . . 0.0 111.28 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.06 -97.31 0.07 OUTLIER Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.2 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.43 -174.97 0.16 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.97 0.414 . . . . 0.0 110.532 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.44 141.53 3.9 Favored Glycine 0 CA--C 1.512 -0.147 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.634 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -55.46 164.18 1.07 Allowed 'General case' 0 C--O 1.243 0.735 0 CA-C-O 120.992 0.425 . . . . 0.0 110.847 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.3 -25.38 66.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.4 0.619 . . . . 0.0 111.006 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -64.5 0.85 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.8 t -55.61 -34.08 64.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.184 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -65.2 -46.16 81.82 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.902 0.382 . . . . 0.0 110.715 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.5 m -75.99 -25.94 56.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 41.3 mtp -63.88 -55.4 23.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.831 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -65.15 -38.72 91.5 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.56 0.537 . . . . 0.0 110.882 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 -63.94 -25.43 68.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 110.919 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -120.38 50.2 1.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.81 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -65.28 -25.85 67.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.946 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -83.89 -28.89 27.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.973 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -141.49 74.18 23.95 Favored Pre-proline 0 C--O 1.232 0.172 0 CA-C-O 121.732 0.777 . . . . 0.0 110.569 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.702 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.2 Cg_endo -69.4 -7.77 21.83 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.778 2.319 . . . . 0.0 112.425 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -75.36 -15.16 60.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.77 0.62 28.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.085 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.702 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.0 t -54.39 -38.22 39.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.085 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -55.21 28.16 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.639 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.22 -32.63 56.36 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.654 0.596 . . . . 0.0 111.141 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.8 t -75.37 -45.19 40.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.646 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.95 -42.12 93.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.995 0.426 . . . . 0.0 110.996 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.6 t -51.29 -38.46 52.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.353 0.597 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.51 -52.46 10.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.676 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.4 t -54.89 -55.11 34.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.788 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -66.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 110.785 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.0 mmt-85 -67.45 -174.93 0.44 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.951 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -173.89 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.712 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.06 -16.02 57.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.122 0.487 . . . . 0.0 111.09 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -110.6 -135.16 6.87 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.691 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -163.24 37.94 0.33 Allowed Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.998 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.59 -159.38 13.89 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.219 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 . . . . . 0 C--N 1.332 -0.171 0 O-C-N 122.614 -0.344 . . . . 0.0 110.622 -179.439 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.705 0 CA-C-O 120.316 -0.158 . . . . 0.0 112.746 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.87 -170.75 3.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.913 0.387 . . . . 0.0 110.879 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 71.38 31.82 65.57 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.324 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -126.46 143.93 51.02 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 122.318 -0.519 . . . . 0.0 110.867 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -139.97 69.88 0.46 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.813 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 p -70.41 162.76 28.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.982 0.42 . . . . 0.0 110.476 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 m -58.91 -28.91 66.65 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.943 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.22 -64.26 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.723 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.3 t -57.6 -34.46 69.28 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.108 0.48 . . . . 0.0 110.636 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -68.77 -44.8 72.91 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.63 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -71.6 -32.0 67.54 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.389 0.614 . . . . 0.0 111.02 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 mtm -67.85 -46.52 71.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -65.98 -35.77 81.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.862 0.363 . . . . 0.0 111.099 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ttt85 -71.76 -28.29 63.54 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.52 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -117.51 50.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.139 0.495 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.61 -26.16 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.607 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -82.8 -42.58 17.73 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.95 0.405 . . . . 0.0 110.745 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -124.06 74.6 58.12 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.812 0.815 . . . . 0.0 110.739 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.693 ' HA ' HG23 ' A' ' 22' ' ' VAL . 51.0 Cg_endo -70.01 -8.4 23.52 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.801 2.334 . . . . 0.0 112.116 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -75.34 -14.63 60.49 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.013 0.435 . . . . 0.0 111.283 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.6 -0.6 27.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.126 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.693 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.9 t -54.05 -41.65 51.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.517 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.76 -48.07 63.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.124 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.96 -35.73 69.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.547 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -74.89 -44.52 48.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.646 0.26 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.3 -40.24 87.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.046 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t -57.56 -46.83 83.46 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.038 0.447 . . . . 0.0 110.773 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.33 -49.42 19.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.9 t -54.52 -46.31 73.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.726 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.92 -64.03 0.97 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.803 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 155.56 7.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.059 -179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -158.34 71.79 0.59 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.863 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -142.69 13.84 1.93 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.804 0.335 . . . . 0.0 111.112 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -109.18 -73.02 0.76 Allowed Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.847 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.6 -67.55 0.8 Allowed Glycine 0 CA--C 1.519 0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.223 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 89.53 -176.37 43.09 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.4 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-O 120.617 0.246 . . . . 0.0 111.087 -179.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.509 0 N-CA-C 112.045 -0.422 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.6 t 58.1 66.15 1.16 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.121 0.486 . . . . 0.0 111.041 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 157.81 123.07 0.73 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.353 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -143.28 129.13 19.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.61 0.243 . . . . 0.0 111.032 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -148.8 -170.85 16.98 Favored Glycine 0 CA--C 1.507 -0.406 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.675 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.32 133.48 11.59 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.492 0.187 . . . . 0.0 111.146 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -55.73 -26.09 43.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.086 0.469 . . . . 0.0 111.192 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -64.54 1.02 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -54.4 -37.87 65.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.937 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -66.84 -47.1 73.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.114 0.483 . . . . 0.0 110.806 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.1 m -67.12 -35.23 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.7 mtm -65.57 -41.48 92.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.502 0.668 . . . . 0.0 111.142 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.5 -39.11 93.18 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.682 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -74.58 -26.72 60.12 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.01 0.434 . . . . 0.0 110.633 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -117.31 45.48 1.89 Allowed 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.02 -26.14 68.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.951 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -89.62 -38.57 13.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.533 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -123.32 68.09 37.68 Favored Pre-proline 0 N--CA 1.451 -0.391 0 CA-C-O 121.787 0.804 . . . . 0.0 111.028 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.76 ' HA ' HG23 ' A' ' 22' ' ' VAL . 54.5 Cg_endo -69.64 -5.17 15.49 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.665 2.243 . . . . 0.0 112.534 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 5.4 m0 -70.6 -17.94 62.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.724 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -105.81 7.66 32.45 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.291 0.369 . . . . 0.0 110.446 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.76 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.4 t -54.22 -44.78 66.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -53.65 46.37 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.561 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -55.16 -32.73 62.36 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.041 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -74.74 -45.18 45.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.145 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.16 -41.38 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-O 121.676 0.751 . . . . 0.0 111.279 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -38.19 58.82 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.698 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -75.53 -51.87 11.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.906 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.6 t -54.85 -55.51 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.392 0.615 . . . . 0.0 110.996 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -61.26 -66.34 0.55 Allowed 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.33 -173.42 0.41 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.295 0.569 . . . . 0.0 110.499 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 52.57 34.53 15.84 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.396 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -76.42 -16.47 59.69 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.067 0.46 . . . . 0.0 110.978 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -52.21 -54.72 25.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.165 -0.54 . . . . 0.0 112.179 -179.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.61 -106.17 0.2 Allowed Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.944 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.09 -164.57 42.53 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.575 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.2 t70 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.843 0.354 . . . . 0.0 110.626 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.75 149.55 37.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.757 0.313 . . . . 0.0 111.235 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.77 -146.09 44.95 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.287 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -133.01 146.15 51.5 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 120.684 0.278 . . . . 0.0 110.937 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.99 133.01 2.15 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.411 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.84 148.85 24.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.973 0.416 . . . . 0.0 111.055 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.8 m -55.87 -26.35 46.67 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.82 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -64.7 0.94 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.889 0.376 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -53.65 -38.1 63.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.631 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -65.82 -48.33 72.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.4 m -67.9 -29.48 68.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.0 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.75 -47.11 70.19 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.223 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -65.11 -35.88 82.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -73.13 -27.12 61.5 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.953 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -117.93 41.18 2.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.921 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -64.24 -25.11 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.923 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -84.93 -25.43 27.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -140.79 71.52 29.81 Favored Pre-proline 0 N--CA 1.453 -0.295 0 CA-C-O 121.622 0.725 . . . . 0.0 111.177 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.689 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.8 Cg_endo -69.56 -6.22 17.96 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.534 2.156 . . . . 0.0 112.534 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -79.23 10.59 3.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.769 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -138.68 8.34 2.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.472 -179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.689 HG23 ' HA ' ' A' ' 19' ' ' PRO . 47.5 t -57.97 -40.73 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 121.044 0.449 . . . . 0.0 111.367 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -51.4 -48.43 62.62 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.624 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -56.2 -34.69 66.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.943 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -75.06 -44.16 49.16 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.266 0.555 . . . . 0.0 111.132 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -64.9 -41.71 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.805 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.0 t -52.01 -37.71 54.32 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.442 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -74.95 -52.71 10.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.394 0.616 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.43 -55.77 25.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.862 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -60.0 -35.13 74.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.868 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.67 157.17 5.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.446 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 54.55 65.33 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -16.61 42.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.769 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -162.02 174.55 38.5 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.243 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 172.8 -96.77 0.11 Allowed Glycine 0 C--O 1.222 -0.596 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.489 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -98.28 170.88 25.01 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.246 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.69 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.685 0 N-CA-C 112.27 -0.332 . . . . 0.0 112.27 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.4 t -154.95 87.54 1.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.815 0.341 . . . . 0.0 111.133 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.68 -79.81 1.26 Allowed Glycine 0 C--N 1.329 0.14 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.69 -179.94 3.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.671 0.272 . . . . 0.0 111.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.0 140.06 10.17 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.415 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.57 145.31 21.29 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.768 0.318 . . . . 0.0 110.712 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.5 m -56.24 -27.48 55.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.12 0.486 . . . . 0.0 110.715 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -73.49 -63.77 1.13 Allowed 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.931 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -54.43 -38.03 65.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.224 0.535 . . . . 0.0 110.778 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -64.41 -47.07 80.56 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.736 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.458 ' HB3' HG13 ' A' ' 22' ' ' VAL . 52.1 m -71.42 -24.8 62.1 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.747 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 17.4 mtm -72.99 -43.68 61.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.218 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -68.74 -35.9 77.7 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.672 0.607 . . . . 0.0 111.032 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -71.6 -28.65 63.95 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.595 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -117.72 48.31 1.4 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.054 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.11 -26.92 68.75 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -85.98 -27.35 24.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.557 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -138.7 69.91 44.42 Favored Pre-proline 0 C--O 1.231 0.107 0 CA-C-O 121.895 0.855 . . . . 0.0 110.888 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.725 ' HA ' HG23 ' A' ' 22' ' ' VAL . 48.2 Cg_endo -70.17 -6.46 18.85 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.923 2.415 . . . . 0.0 111.793 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -74.87 -14.63 60.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.42 0.66 27.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.052 0.453 . . . . 0.0 110.912 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.725 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.4 t -55.53 -34.06 34.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.068 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.35 -55.84 24.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.7 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.03 -31.35 61.01 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.576 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.7 t -75.7 -44.95 39.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.974 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.6 t -65.17 -41.13 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.57 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.4 t -52.49 -37.9 58.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.865 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.2 -52.67 10.36 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.834 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.3 t -54.6 -55.18 32.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.028 0.442 . . . . 0.0 110.634 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -60.66 -30.11 69.7 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.41 111.53 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.465 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 54.14 57.27 6.07 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.485 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -75.38 -16.2 60.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.857 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.89 -35.42 90.77 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 121.15 -0.548 . . . . 0.0 112.04 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.59 68.17 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.642 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.9 173.31 25.5 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.514 -0.85 . . . . 0.0 112.617 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 C--O 1.243 0.75 0 CA-C-O 121.023 0.44 . . . . 0.0 110.979 -179.498 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 CA-C-O 121.049 0.249 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m 60.76 75.28 0.42 Allowed 'General case' 0 C--O 1.235 0.34 0 O-C-N 122.666 -0.314 . . . . 0.0 111.245 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.94 -103.52 0.18 Allowed Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.02 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.88 139.31 53.01 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.803 0.335 . . . . 0.0 110.753 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -139.49 -84.78 0.11 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.582 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.61 145.02 20.99 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.222 0.534 . . . . 0.0 110.824 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -59.13 -27.44 65.63 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.12 -63.83 1.1 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.924 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.9 m -53.39 -39.34 64.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.057 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.98 -48.05 80.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.983 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB3' HG13 ' A' ' 22' ' ' VAL . 50.6 m -70.84 -24.9 62.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.707 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.9 mtm -72.63 -44.17 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.886 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -69.1 -35.25 76.25 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.772 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -72.01 -28.75 63.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.643 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -117.42 48.51 1.34 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -27.34 69.14 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.795 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.66 -27.41 25.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 0.0 110.839 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.98 69.53 42.41 Favored Pre-proline 0 C--O 1.235 0.337 0 CA-C-O 121.51 0.671 . . . . 0.0 110.886 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.717 ' HA ' HG23 ' A' ' 22' ' ' VAL . 53.5 Cg_endo -69.51 -6.59 18.85 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.908 2.405 . . . . 0.0 112.464 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -74.39 -15.02 60.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.772 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.81 0.84 26.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.894 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.717 HG23 ' HA ' ' A' ' 19' ' ' PRO . 27.7 t -55.03 -34.74 32.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -55.09 34.85 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.701 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -54.83 -31.9 59.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.522 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.8 t -75.98 -44.4 39.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 123.589 0.556 . . . . 0.0 111.062 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -65.6 -41.31 90.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.909 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -37.67 57.79 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -75.23 -52.58 10.56 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.325 0.583 . . . . 0.0 111.186 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -55.07 -54.89 37.35 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.955 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ttm180 -59.73 -35.0 73.66 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.921 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.0 156.05 9.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.928 0.394 . . . . 0.0 110.73 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -160.31 27.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.162 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -81.51 -15.63 54.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -105.69 -166.08 23.45 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.454 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.9 51.19 0.02 OUTLIER Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.433 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -84.23 -145.95 7.22 Favored Glycine 0 CA--C 1.509 -0.326 0 C-N-CA 120.285 -0.96 . . . . 0.0 112.373 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.946 0.403 . . . . 0.0 110.628 -179.733 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 N-CA-C 112.465 -0.254 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.4 m -148.92 89.39 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.085 0.469 . . . . 0.0 110.904 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.28 127.57 8.11 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.458 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.83 102.75 11.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.115 0.483 . . . . 0.0 110.833 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -113.27 -103.06 2.58 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.37 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.59 146.2 22.07 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.662 0.268 . . . . 0.0 111.033 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.0 -26.92 68.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.576 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HD3' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -74.26 -64.32 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.202 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 t -52.13 -36.49 51.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.063 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -67.29 -51.43 52.83 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.127 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB3' HG13 ' A' ' 22' ' ' VAL . 51.2 m -64.51 -29.01 70.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.9 mtp -68.92 -47.19 66.37 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.806 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -65.62 -36.41 83.64 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.676 0.61 . . . . 0.0 110.94 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ttt-85 -71.82 -26.26 62.32 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -117.98 48.95 1.3 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.48 -25.65 67.58 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.101 0.477 . . . . 0.0 110.746 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -83.17 -30.0 28.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -140.14 74.41 30.55 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.49 0.662 . . . . 0.0 110.603 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.704 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.5 Cg_endo -69.64 -7.93 22.28 Favored 'Trans proline' 0 N--CA 1.474 0.327 0 C-N-CA 122.721 2.281 . . . . 0.0 112.231 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.33 -14.81 60.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.952 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.98 -0.08 27.22 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.4 t -54.83 -35.0 32.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -54.27 42.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.12 -32.75 55.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.957 0.408 . . . . 0.0 111.182 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -75.55 -44.71 42.01 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.753 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.55 HG21 ' HD3' ' A' ' 8' ' ' ARG . 68.9 t -65.1 -41.81 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.233 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -52.05 -38.5 57.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.958 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -74.46 -52.75 11.1 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.053 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.4 t -54.94 -54.93 36.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.691 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -61.74 -67.64 0.39 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -68.64 -170.73 0.23 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.09 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -170.66 73.58 0.06 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.507 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -94.14 40.52 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.182 0.515 . . . . 0.0 110.823 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -172.83 -102.78 0.16 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.754 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -173.98 -42.21 0.05 OUTLIER Glycine 0 C--N 1.334 0.453 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.146 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -138.36 -135.01 3.27 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.228 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.552 0 CA-C-O 121.067 0.46 . . . . 0.0 110.794 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 112.261 -0.335 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 95.6 p -53.15 148.23 8.58 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.456 0.645 . . . . 0.0 110.973 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 146.2 -173.44 26.49 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.218 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -132.12 120.73 22.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.214 0.531 . . . . 0.0 110.906 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.1 57.88 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.526 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.8 155.69 15.64 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.679 0.276 . . . . 0.0 110.846 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 86.8 m -52.83 -35.67 57.51 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.998 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -64.09 -64.28 0.93 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.236 0.541 . . . . 0.0 111.306 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 t -56.52 -36.43 69.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.2 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -67.03 -44.57 79.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.705 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.527 ' HB3' HG13 ' A' ' 22' ' ' VAL . 44.4 m -71.63 -30.79 66.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.801 0.334 . . . . 0.0 111.192 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.8 mtm -69.32 -44.85 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.41 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -68.34 -35.56 77.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.672 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -71.79 -25.87 62.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.06 0.457 . . . . 0.0 111.505 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -118.53 49.51 1.28 Allowed 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -64.35 -26.39 68.45 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.19 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.07 -29.9 28.43 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.675 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -141.04 74.25 25.64 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.786 0.803 . . . . 0.0 110.912 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.712 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.3 Cg_endo -70.01 -7.86 22.18 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.554 2.17 . . . . 0.0 111.899 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -75.43 -14.63 60.46 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.761 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.31 0.09 26.73 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.32 -179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.712 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.1 t -54.69 -35.4 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.829 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.78 -53.23 51.17 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.255 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.03 -32.35 61.79 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.688 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -75.76 -45.54 35.82 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.258 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.14 -40.11 87.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.231 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -53.25 -37.41 62.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -75.34 -55.81 5.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.388 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -53.96 -34.68 60.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.659 0.743 . . . . 0.0 111.337 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.08 -58.02 8.89 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.812 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.17 173.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -86.81 42.56 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 123.537 0.523 . . . . 0.0 111.029 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 ptt85 -75.14 -16.14 60.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.824 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -103.96 -131.72 7.3 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.434 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 178.73 -53.56 0.09 OUTLIER Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.434 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 84.96 141.15 5.33 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.32 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.5 t0 . . . . . 0 C--O 1.236 0.352 0 CA-C-O 120.969 0.414 . . . . 0.0 110.834 179.986 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.392 0 CA-C-O 121.096 0.275 . . . . 0.0 112.426 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -117.22 118.01 31.14 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.226 0.536 . . . . 0.0 110.83 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 163.46 -81.6 0.12 Allowed Glycine 0 CA--C 1.525 0.687 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.644 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.3 mtt-85 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.579 0.228 . . . . 0.0 111.177 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -102.64 128.42 9.54 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.263 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.2 p -67.63 -170.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.27 0.557 . . . . 0.0 110.631 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.2 m -96.6 -25.25 15.67 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.816 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.543 ' HD3' HG21 ' A' ' 26' ' ' VAL . 2.1 tpp180 -73.67 -63.9 1.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.811 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -55.65 -36.21 66.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.824 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -66.62 -46.05 77.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.992 0.425 . . . . 0.0 110.64 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -71.45 -27.87 63.56 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 mtm -69.65 -45.78 67.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.057 0.456 . . . . 0.0 110.757 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.97 -36.13 82.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.815 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ttt85 -73.44 -26.01 60.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.616 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -118.58 48.53 1.43 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.706 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -65.52 -25.58 67.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.744 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -81.99 -34.36 29.71 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.169 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -134.39 73.82 67.93 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-O 121.514 0.673 . . . . 0.0 110.633 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.696 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.9 Cg_endo -69.0 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.333 -0.253 0 C-N-CA 123.156 2.571 . . . . 0.0 112.35 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -75.51 -13.99 60.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.65 0.42 26.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.762 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.696 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.6 t -54.69 -36.97 38.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.735 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.61 -54.82 32.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.058 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.37 -32.77 57.76 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -75.29 -44.53 45.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.082 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.543 HG21 ' HD3' ' A' ' 8' ' ' ARG . 69.9 t -65.59 -41.62 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 t -52.2 -38.17 57.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.521 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -75.02 -53.06 9.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 0.0 111.009 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.7 t -54.77 -55.25 32.05 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.415 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -59.87 -31.72 70.04 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.397 0.618 . . . . 0.0 111.286 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.07 149.62 44.65 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.08 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 14.32 7.79 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.748 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.15 25.44 4.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.25 169.81 29.57 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.592 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.05 33.74 10.55 Favored Glycine 0 CA--C 1.511 -0.212 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.382 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.39 172.11 24.88 Favored Glycine 0 N--CA 1.455 -0.092 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.714 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 120.732 0.301 . . . . 0.0 110.678 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.461 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 52.89 42.55 32.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.808 0.337 . . . . 0.0 111.147 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 103.73 40.95 2.24 Favored Glycine 0 CA--C 1.506 -0.486 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.409 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 44.87 -164.36 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.382 0 CA-C-O 121.325 0.583 . . . . 0.0 110.434 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.24 -137.05 23.25 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.337 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.4 148.46 24.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.569 0.223 . . . . 0.0 110.693 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.1 m -61.62 -27.93 69.0 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.671 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -73.95 -63.72 1.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.161 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.8 t -52.91 -35.78 58.7 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.801 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -66.25 -52.11 50.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.138 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.4 m -66.65 -25.21 66.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 52.2 mtp -72.49 -45.01 61.46 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.531 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -68.56 -35.92 78.07 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.48 -28.16 63.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -117.8 50.84 1.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.595 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.59 -26.05 67.67 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.592 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.05 -44.38 16.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -122.28 74.43 40.67 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.857 0.837 . . . . 0.0 110.952 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.697 ' HA ' HG23 ' A' ' 22' ' ' VAL . 50.4 Cg_endo -70.19 -8.1 22.79 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.823 2.349 . . . . 0.0 111.959 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 1.5 m0 -75.19 -15.12 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.127 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.01 0.53 27.77 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.697 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.2 t -54.6 -43.79 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.246 0.546 . . . . 0.0 110.947 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -51.05 -45.68 61.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.151 0.501 . . . . 0.0 111.236 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.87 -34.76 71.97 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.408 0.623 . . . . 0.0 110.959 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.5 t -75.47 -44.42 44.19 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.138 0.494 . . . . 0.0 110.806 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.7 t -65.37 -41.42 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.045 0.45 . . . . 0.0 111.377 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.1 m -52.04 -37.98 55.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.801 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -75.95 -51.87 11.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.666 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.6 t -55.58 -54.22 46.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.088 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -60.67 -31.45 70.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.081 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -62.9 164.43 8.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.937 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.6 mtt-85 55.82 57.4 5.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.923 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -16.37 58.27 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.479 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -68.14 143.16 40.77 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.822 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 153.57 -86.26 0.14 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.658 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -106.94 145.48 15.96 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.473 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 120.59 0.233 . . . . 0.0 110.508 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.9 m -103.52 -179.78 4.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.672 0.236 . . . . 0.0 110.781 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 107.65 81.78 1.4 Allowed Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.337 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.58 62.67 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.948 0.404 . . . . 0.0 111.166 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -112.02 159.14 13.89 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.704 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p -60.49 155.71 17.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.231 0.538 . . . . 0.0 110.815 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.65 -26.3 65.4 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.475 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.39 -64.09 1.02 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.766 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -41.66 60.06 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.633 0.254 . . . . 0.0 111.135 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -65.04 -49.32 70.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.765 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.1 m -62.6 -36.45 82.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.232 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.8 mtm -64.17 -47.06 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.652 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -64.74 -36.14 83.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.805 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -74.25 -30.21 62.04 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.207 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -115.71 35.92 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.168 0.509 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.18 -25.71 65.78 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.025 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -83.01 -25.82 31.82 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.529 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -139.22 71.88 39.44 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.79 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.4 Cg_endo -69.51 -6.68 19.05 Favored 'Trans proline' 0 C--N 1.334 -0.224 0 C-N-CA 122.532 2.155 . . . . 0.0 112.543 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -76.5 0.2 20.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.838 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -130.26 12.6 5.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 110.731 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.79 HG23 ' HA ' ' A' ' 19' ' ' PRO . 24.1 t -59.39 -39.85 80.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.653 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -51.8 63.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.982 0.42 . . . . 0.0 110.978 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.39 -32.49 57.28 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -74.81 -45.32 44.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.235 0.54 . . . . 0.0 111.045 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.08 -41.48 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.422 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -37.54 59.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.31 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -75.0 -52.2 11.71 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.442 0.639 . . . . 0.0 111.364 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -54.91 -55.35 31.54 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.958 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -35.79 76.45 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.017 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.98 126.31 24.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.935 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 62.21 71.09 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.183 0.302 . . . . 0.0 110.739 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -92.98 43.81 1.13 Allowed 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 121.19 0.519 . . . . 0.0 110.857 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -129.37 -41.46 0.25 Allowed Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.498 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.18 -21.46 71.96 Favored Glycine 0 C--O 1.226 -0.382 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.766 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 168.02 -163.52 37.22 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.714 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.3 t70 . . . . . 0 C--N 1.327 -0.406 0 CA-C-O 121.08 0.466 . . . . 0.0 110.727 179.559 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 120.448 0.166 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -64.2 -64.33 0.91 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.281 0.563 . . . . 0.0 110.943 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.16 -34.68 66.4 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.737 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -68.04 -47.46 68.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.427 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -71.19 -26.53 63.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.108 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.2 mtm -69.04 -48.62 62.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.085 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -68.2 -35.67 78.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.333 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -69.34 -27.07 65.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -118.48 49.22 1.31 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.902 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 . . . . . 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.657 -179.805 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.224 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.26 -39.45 43.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.023 0.44 . . . . 0.0 111.198 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -50.85 -48.16 60.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.002 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.74 -35.73 71.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -75.13 -43.73 51.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.247 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 73.5 t -64.77 -40.81 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-O 120.808 0.337 . . . . 0.0 111.024 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 t -57.59 -45.64 85.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.946 0.403 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.48 -49.18 19.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.431 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 44.0 t -55.19 -45.29 75.81 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.485 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -72.58 -63.81 1.08 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.839 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.7 t -55.06 -35.89 65.0 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.099 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -65.53 -47.16 76.87 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.399 0.437 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.79 -26.66 62.51 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.04 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.5 mtm -71.07 -44.76 65.07 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -36.4 82.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.489 0.661 . . . . 0.0 111.073 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -72.14 -28.58 63.34 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -117.31 49.02 1.24 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.789 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 O-C-N 123.44 0.462 . . . . 0.0 110.523 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.526 0.047 0 CA-C-O 120.331 0.11 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.0 t -55.28 -42.51 66.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 O-C-N 123.597 0.561 . . . . 0.0 110.611 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.16 -48.99 61.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.776 0.322 . . . . 0.0 110.693 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.57 -34.4 67.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.847 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.67 -43.92 45.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.75 -40.96 89.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.165 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.23 -38.44 58.02 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 121.02 0.438 . . . . 0.0 110.849 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.38 -52.37 10.93 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.599 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -54.63 -54.66 38.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.293 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 . . . . . 0 N--CA 1.454 -0.23 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.692 -179.695 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 81.4 m . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.667 0.27 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -73.78 -64.56 0.97 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.04 -38.51 65.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.823 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.35 -47.11 74.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.961 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 m -67.87 -28.34 67.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.092 0.472 . . . . 0.0 111.005 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.3 mtm -71.2 -42.82 68.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.528 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -66.62 -35.88 81.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -26.03 59.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.031 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -117.85 43.99 2.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.185 0.517 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.31 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.05 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 . . . . . 0 C--O 1.224 -0.252 0 CA-C-O 121.528 0.68 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -54.78 -44.88 73.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.249 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -51.31 -47.82 62.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.21 0.528 . . . . 0.0 111.308 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -56.62 -35.73 68.64 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.049 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 30.8 t -74.74 -45.22 45.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.28 -41.06 91.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.198 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -38.69 61.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.492 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -74.9 -52.38 11.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.18 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.63 -54.84 36.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.246 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 . . . . . 0 C--O 1.24 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.655 179.884 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.9 m . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.995 0.426 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.544 ' HD2' HG21 ' A' ' 26' ' ' VAL . 2.1 tpt180 -75.68 -63.29 1.33 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.978 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.55 -36.96 56.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.79 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -67.39 -51.77 47.89 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.379 0.424 . . . . 0.0 111.035 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 m -65.24 -25.19 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.487 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 55.8 mtp -72.39 -43.01 64.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.122 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtt-85 -66.75 -36.28 82.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.86 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -73.83 -26.27 60.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.077 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -118.04 43.82 2.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.819 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 . . . . . 0 C--O 1.235 0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -179.868 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.851 0.357 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -53.85 -45.8 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 121.363 0.602 . . . . 0.0 111.228 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -44.74 62.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.947 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.65 -35.78 73.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.39 0.614 . . . . 0.0 111.325 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.72 -44.18 43.26 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.544 HG21 ' HD2' ' A' ' 8' ' ' ARG . 72.9 t -64.0 -41.75 93.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.219 0.533 . . . . 0.0 111.277 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -38.22 59.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.059 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -74.77 -52.37 11.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.011 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.4 t -55.17 -55.05 35.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 . . . . . 0 N--CA 1.464 0.253 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.063 -179.99 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.049 0.452 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -72.44 -63.84 1.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.491 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.4 t -55.31 -37.13 66.98 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.562 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.63 -47.14 76.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 111.143 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -69.61 -28.57 66.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.296 0.57 . . . . 0.0 110.795 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.7 mtt -68.49 -46.25 70.19 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.215 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -36.2 83.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.847 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.0 -25.92 60.17 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.907 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -117.79 40.04 3.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.823 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.548 0 O-C-N 123.176 0.297 . . . . 0.0 110.421 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.343 0.592 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.7 t -56.53 -40.93 71.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.637 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -45.39 63.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.29 -35.7 72.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.089 0.471 . . . . 0.0 110.401 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.8 t -75.52 -44.57 42.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.923 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -64.21 -41.16 91.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.886 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.4 t -52.5 -38.12 58.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.311 0.576 . . . . 0.0 110.935 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -75.0 -53.07 9.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.755 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -54.68 -55.06 33.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.015 -179.915 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.456 -0.156 0 CA-C-O 121.041 0.448 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -65.27 -63.72 1.03 Allowed 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.982 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -40.3 64.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -66.14 -47.97 72.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.575 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 m -64.67 -33.28 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.791 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtm -66.77 -44.42 81.4 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.581 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -66.81 -36.02 81.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.916 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -74.02 -27.82 61.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.793 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -118.24 35.53 4.71 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.465 0.478 . . . . 0.0 110.577 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 . . . . . 0 C--N 1.327 -0.387 0 O-C-N 123.458 0.474 . . . . 0.0 110.626 179.994 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 . . . . . 0 N--CA 1.463 0.204 0 CA-C-O 120.544 0.211 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -59.81 -42.08 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.649 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -51.74 -48.47 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.338 0.399 . . . . 0.0 110.789 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.52 -35.28 63.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.095 0.474 . . . . 0.0 111.081 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.0 t -75.62 -45.55 36.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.339 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.66 -40.19 87.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.389 0.614 . . . . 0.0 111.533 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.02 -42.24 80.01 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.067 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.22 -52.42 10.94 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.565 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.8 t -54.0 -43.76 70.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.786 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.8 m . . . . . 0 C--O 1.24 0.581 0 CA-C-O 120.643 0.259 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.6 -63.89 1.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.919 0.39 . . . . 0.0 111.209 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -54.89 -36.84 65.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.799 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -65.76 -45.93 80.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.865 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.28 -26.42 61.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.691 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 mtm -71.84 -44.78 63.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.899 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -67.45 -36.29 80.9 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.018 0.437 . . . . 0.0 110.74 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -72.12 -26.11 62.0 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.906 0.384 . . . . 0.0 111.174 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.91 49.13 1.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.869 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 C--N 1.323 -0.547 0 O-C-N 123.547 0.53 . . . . 0.0 111.055 -179.924 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.874 0.368 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.0 t -54.35 -42.23 56.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.429 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -50.79 -48.52 59.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.136 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.16 -34.94 68.96 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.595 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 t -74.8 -44.82 47.37 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.064 0.459 . . . . 0.0 110.735 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.4 t -64.82 -41.78 93.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.088 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.33 -38.02 57.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.116 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -74.91 -52.89 10.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.1 t -54.96 -54.24 45.43 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.433 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 . . . . . 0 CA--C 1.534 0.333 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.527 -179.8 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.7 m . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.985 0.421 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -73.38 -64.17 1.04 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.028 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -55.38 -36.06 65.96 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -65.62 -46.07 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.263 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -73.02 -25.44 60.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.567 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.2 mtm -71.76 -45.23 62.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.203 0.525 . . . . 0.0 111.085 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmm-85 -68.13 -34.96 77.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -72.24 -27.04 62.26 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.759 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.74 49.77 1.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.345 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.45 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.3 t -54.49 -42.22 58.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.009 0.433 . . . . 0.0 111.399 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -51.17 -48.12 61.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.954 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.32 -34.63 68.93 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.794 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.2 t -75.38 -44.33 45.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.264 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.85 -41.37 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.358 0.599 . . . . 0.0 111.45 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -55.29 -39.82 70.32 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.805 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -75.03 -51.17 14.23 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.0 0.429 . . . . 0.0 111.071 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.2 t -55.3 -54.31 45.13 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.8 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 . . . . . 0 C--N 1.328 -0.357 0 CA-C-O 121.096 0.474 . . . . 0.0 110.793 -179.828 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.2 m . . . . . 0 C--O 1.234 0.258 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -64.45 -63.99 0.99 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -57.36 -36.01 70.67 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.52 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -67.84 -43.83 78.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.68 -31.15 64.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.742 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.2 mtm -67.49 -46.96 71.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.569 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -65.72 -35.57 81.11 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.136 0.493 . . . . 0.0 111.215 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -73.07 -25.64 60.97 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -119.13 49.48 1.33 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.498 0.499 . . . . 0.0 110.989 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.032 -179.687 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -54.16 -35.9 30.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.105 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -54.34 43.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.54 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -55.03 -32.56 61.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.3 t -75.35 -44.65 43.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.01 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -65.48 -40.6 88.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.722 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -56.88 -42.48 79.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 110.526 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -75.22 -52.44 10.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.816 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.1 t -55.05 -42.74 73.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.43 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m . . . . . 0 C--O 1.235 0.303 0 CA-C-O 121.4 0.619 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -64.5 0.85 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.8 t -55.61 -34.08 64.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.184 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -65.2 -46.16 81.82 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.902 0.382 . . . . 0.0 110.715 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.5 m -75.99 -25.94 56.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 41.3 mtp -63.88 -55.4 23.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.831 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -65.15 -38.72 91.5 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.56 0.537 . . . . 0.0 110.882 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 -63.94 -25.43 68.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 110.919 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -120.38 50.2 1.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.81 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.946 -179.88 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.763 0.316 . . . . 0.0 111.085 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.0 t -54.39 -38.22 39.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.085 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -55.21 28.16 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.639 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.22 -32.63 56.36 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.654 0.596 . . . . 0.0 111.141 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.8 t -75.37 -45.19 40.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.646 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.95 -42.12 93.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.995 0.426 . . . . 0.0 110.996 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.6 t -51.29 -38.46 52.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.353 0.597 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.51 -52.46 10.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.676 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.4 t -54.89 -55.11 34.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.788 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 110.785 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.22 -64.26 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.723 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.3 t -57.6 -34.46 69.28 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.108 0.48 . . . . 0.0 110.636 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -68.77 -44.8 72.91 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.63 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -71.6 -32.0 67.54 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.389 0.614 . . . . 0.0 111.02 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 mtm -67.85 -46.52 71.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -65.98 -35.77 81.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.862 0.363 . . . . 0.0 111.099 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ttt85 -71.76 -28.29 63.54 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.52 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -117.51 50.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.139 0.495 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.607 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.9 t -54.05 -41.65 51.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.517 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.76 -48.07 63.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.124 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.96 -35.73 69.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.547 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -74.89 -44.52 48.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.646 0.26 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.3 -40.24 87.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.046 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t -57.56 -46.83 83.46 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.038 0.447 . . . . 0.0 110.773 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.33 -49.42 19.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.9 t -54.52 -46.31 73.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.726 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.803 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 121.086 0.469 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -64.54 1.02 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -54.4 -37.87 65.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.937 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -66.84 -47.1 73.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.114 0.483 . . . . 0.0 110.806 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.1 m -67.12 -35.23 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.7 mtm -65.57 -41.48 92.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.502 0.668 . . . . 0.0 111.142 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.5 -39.11 93.18 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.682 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -74.58 -26.72 60.12 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.01 0.434 . . . . 0.0 110.633 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -117.31 45.48 1.89 Allowed 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.951 179.933 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.569 0.223 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -54.22 -44.78 66.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.932 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -53.65 46.37 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.561 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -55.16 -32.73 62.36 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.041 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -74.74 -45.18 45.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.145 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.16 -41.38 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-O 121.676 0.751 . . . . 0.0 111.279 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -38.19 58.82 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.698 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -75.53 -51.87 11.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.906 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.6 t -54.85 -55.51 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.392 0.615 . . . . 0.0 110.996 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.808 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.8 m . . . . . 0 C--O 1.238 0.47 0 CA-C-O 120.75 0.31 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -64.7 0.94 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.889 0.376 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -53.65 -38.1 63.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.631 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -65.82 -48.33 72.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.4 m -67.9 -29.48 68.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.0 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.75 -47.11 70.19 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.223 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -65.11 -35.88 82.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -73.13 -27.12 61.5 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.953 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -117.93 41.18 2.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.921 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.803 0.335 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.5 t -57.97 -40.73 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 121.044 0.449 . . . . 0.0 111.367 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -51.4 -48.43 62.62 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.624 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -56.2 -34.69 66.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.943 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -75.06 -44.16 49.16 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.266 0.555 . . . . 0.0 111.132 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -64.9 -41.71 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.805 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.0 t -52.01 -37.71 54.32 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.442 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -74.95 -52.71 10.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.394 0.616 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.43 -55.77 25.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.862 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.868 179.981 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.5 m . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 121.12 0.486 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -73.49 -63.77 1.13 Allowed 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.931 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -54.43 -38.03 65.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.224 0.535 . . . . 0.0 110.778 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -64.41 -47.07 80.56 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.736 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.458 ' HB3' HG13 ' A' ' 22' ' ' VAL . 52.1 m -71.42 -24.8 62.1 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.747 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 17.4 mtm -72.99 -43.68 61.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.218 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -68.74 -35.9 77.7 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.672 0.607 . . . . 0.0 111.032 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -71.6 -28.65 63.95 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.595 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -117.72 48.31 1.4 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.054 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 . . . . . 0 CA--C 1.517 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.034 -179.904 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 121.052 0.453 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 11' ' ' CYS . 25.4 t -55.53 -34.06 34.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.068 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.35 -55.84 24.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.7 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.03 -31.35 61.01 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.576 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.7 t -75.7 -44.95 39.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.974 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.6 t -65.17 -41.13 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.57 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.4 t -52.49 -37.9 58.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.865 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.2 -52.67 10.36 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.834 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.3 t -54.6 -55.18 32.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.028 0.442 . . . . 0.0 110.634 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 . . . . . 0 N--CA 1.461 0.104 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 -179.515 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m . . . . . 0 C--O 1.239 0.505 0 CA-C-O 120.58 0.229 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.12 -63.83 1.1 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.924 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.9 m -53.39 -39.34 64.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.057 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.98 -48.05 80.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.983 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB3' HG13 ' A' ' 22' ' ' VAL . 50.6 m -70.84 -24.9 62.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.707 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.9 mtm -72.63 -44.17 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.886 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -69.1 -35.25 76.25 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.772 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -72.01 -28.75 63.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.643 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -117.42 48.51 1.34 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.795 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.66 0.267 . . . . 0.0 110.894 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.461 HG13 ' HB3' ' A' ' 11' ' ' CYS . 27.7 t -55.03 -34.74 32.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -55.09 34.85 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.701 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -54.83 -31.9 59.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.522 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.8 t -75.98 -44.4 39.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 123.589 0.556 . . . . 0.0 111.062 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -65.6 -41.31 90.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.909 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -37.67 57.79 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -75.23 -52.58 10.56 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.325 0.583 . . . . 0.0 111.186 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -55.07 -54.89 37.35 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.955 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ttm180 . . . . . 0 C--O 1.235 0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.921 179.826 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.2 m . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.627 0.251 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HD3' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -74.26 -64.32 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.202 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 t -52.13 -36.49 51.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.063 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -67.29 -51.43 52.83 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.127 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB3' HG13 ' A' ' 22' ' ' VAL . 51.2 m -64.51 -29.01 70.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.9 mtp -68.92 -47.19 66.37 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.806 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -65.62 -36.41 83.64 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.676 0.61 . . . . 0.0 110.94 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ttt-85 -71.82 -26.26 62.32 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -117.98 48.95 1.3 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.239 0.507 0 CA-C-O 121.101 0.477 . . . . 0.0 110.746 -179.494 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.794 0.331 . . . . 0.0 110.805 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 11' ' ' CYS . 28.4 t -54.83 -35.0 32.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -54.27 42.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.12 -32.75 55.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.957 0.408 . . . . 0.0 111.182 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -75.55 -44.71 42.01 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.753 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.55 HG21 ' HD3' ' A' ' 8' ' ' ARG . 68.9 t -65.1 -41.81 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.233 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -52.05 -38.5 57.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.958 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -74.46 -52.75 11.1 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.053 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.4 t -54.94 -54.93 36.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.691 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 -179.819 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 86.8 m . . . . . 0 C--O 1.236 0.362 0 CA-C-O 120.976 0.417 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -64.09 -64.28 0.93 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.236 0.541 . . . . 0.0 111.306 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 t -56.52 -36.43 69.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.2 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -67.03 -44.57 79.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.705 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.527 ' HB3' HG13 ' A' ' 22' ' ' VAL . 44.4 m -71.63 -30.79 66.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.801 0.334 . . . . 0.0 111.192 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.8 mtm -69.32 -44.85 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.41 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -68.34 -35.56 77.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.672 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -71.79 -25.87 62.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.06 0.457 . . . . 0.0 111.505 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -118.53 49.51 1.28 Allowed 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.19 179.798 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.238 0.475 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.527 HG13 ' HB3' ' A' ' 11' ' ' CYS . 28.1 t -54.69 -35.4 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.829 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.78 -53.23 51.17 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.255 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.03 -32.35 61.79 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.688 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -75.76 -45.54 35.82 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.258 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.14 -40.11 87.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.231 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -53.25 -37.41 62.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -75.34 -55.81 5.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.388 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -53.96 -34.68 60.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.659 0.743 . . . . 0.0 111.337 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.238 0.483 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.812 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.2 m . . . . . 0 C--O 1.237 0.413 0 CA-C-O 120.663 0.268 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.543 ' HD3' HG21 ' A' ' 26' ' ' VAL . 2.1 tpp180 -73.67 -63.9 1.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.811 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -55.65 -36.21 66.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.824 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -66.62 -46.05 77.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.992 0.425 . . . . 0.0 110.64 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -71.45 -27.87 63.56 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 mtm -69.65 -45.78 67.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.057 0.456 . . . . 0.0 110.757 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.97 -36.13 82.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.815 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ttt85 -73.44 -26.01 60.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.616 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -118.58 48.53 1.43 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.706 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.744 -179.354 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 120.784 0.326 . . . . 0.0 110.762 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.6 t -54.69 -36.97 38.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.735 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.61 -54.82 32.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.058 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.37 -32.77 57.76 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -75.29 -44.53 45.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.082 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.543 HG21 ' HD3' ' A' ' 8' ' ' ARG . 69.9 t -65.59 -41.62 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 t -52.2 -38.17 57.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.521 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -75.02 -53.06 9.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 0.0 111.009 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.7 t -54.77 -55.25 32.05 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.415 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 . . . . . 0 N--CA 1.448 -0.558 0 CA-C-O 121.397 0.618 . . . . 0.0 111.286 -179.93 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.1 m . . . . . 0 C--O 1.236 0.361 0 CA-C-O 120.782 0.325 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -73.95 -63.72 1.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.161 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.8 t -52.91 -35.78 58.7 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.801 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -66.25 -52.11 50.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.138 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.4 m -66.65 -25.21 66.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 52.2 mtp -72.49 -45.01 61.46 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.531 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -68.56 -35.92 78.07 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.48 -28.16 63.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -117.8 50.84 1.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.595 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.592 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.338 0 CA-C-O 121.096 0.474 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.2 t -54.6 -43.79 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.246 0.546 . . . . 0.0 110.947 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -51.05 -45.68 61.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.151 0.501 . . . . 0.0 111.236 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.87 -34.76 71.97 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.408 0.623 . . . . 0.0 110.959 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.5 t -75.47 -44.42 44.19 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.138 0.494 . . . . 0.0 110.806 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.7 t -65.37 -41.42 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.045 0.45 . . . . 0.0 111.377 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.1 m -52.04 -37.98 55.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.801 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -75.95 -51.87 11.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.666 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.6 t -55.58 -54.22 46.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.088 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.081 179.655 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--O 1.24 0.601 0 CA-C-O 120.809 0.338 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.39 -64.09 1.02 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.766 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -41.66 60.06 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.633 0.254 . . . . 0.0 111.135 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -65.04 -49.32 70.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.765 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.1 m -62.6 -36.45 82.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.232 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.8 mtm -64.17 -47.06 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.652 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -64.74 -36.14 83.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.805 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -74.25 -30.21 62.04 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.207 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -115.71 35.92 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.168 0.509 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 . . . . . 0 C--O 1.221 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.025 179.958 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.921 0.391 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.1 t -59.39 -39.85 80.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.653 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -51.8 63.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.982 0.42 . . . . 0.0 110.978 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.39 -32.49 57.28 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -74.81 -45.32 44.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.235 0.54 . . . . 0.0 111.045 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.08 -41.48 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.422 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -37.54 59.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.31 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -75.0 -52.2 11.71 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.442 0.639 . . . . 0.0 111.364 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -54.91 -55.35 31.54 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.958 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.24 0.569 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.017 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 112.501 -0.24 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m 61.86 32.59 17.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.926 0.393 . . . . 0.0 110.992 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.84 173.8 0.78 Allowed Glycine 0 C--O 1.228 -0.247 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.867 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.08 168.69 9.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.006 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.5 77.16 1.24 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.379 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.43 145.52 21.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.547 0.213 . . . . 0.0 111.412 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.8 m -59.29 -27.68 66.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.882 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -64.2 -64.33 0.91 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.281 0.563 . . . . 0.0 110.943 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.16 -34.68 66.4 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.737 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -68.04 -47.46 68.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.427 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -71.19 -26.53 63.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.108 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.2 mtm -69.04 -48.62 62.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.085 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -68.2 -35.67 78.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.333 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -69.34 -27.07 65.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -118.48 49.22 1.31 Allowed 'General case' 0 C--O 1.238 0.496 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.902 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.17 -26.5 68.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.657 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -81.66 -25.72 35.35 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.208 0.528 . . . . 0.0 111.317 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -145.63 75.57 13.31 Favored Pre-proline 0 C--O 1.236 0.392 0 CA-C-O 121.881 0.848 . . . . 0.0 111.151 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.696 ' HA ' HG23 ' A' ' 22' ' ' VAL . 54.4 Cg_endo -69.5 -7.59 21.39 Favored 'Trans proline' 0 C--O 1.22 -0.38 0 C-N-CA 122.89 2.393 . . . . 0.0 112.567 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.1 m95 -75.95 -14.76 60.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.711 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.57 0.49 26.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.521 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.696 HG23 ' HA ' ' A' ' 19' ' ' PRO . 31.0 t -54.26 -39.45 43.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.023 0.44 . . . . 0.0 111.198 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -50.85 -48.16 60.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.002 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.74 -35.73 71.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -75.13 -43.73 51.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.247 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 73.5 t -64.77 -40.81 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-O 120.808 0.337 . . . . 0.0 111.024 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 t -57.59 -45.64 85.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.946 0.403 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.48 -49.18 19.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.431 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 44.0 t -55.19 -45.29 75.81 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.806 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -63.74 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -54.41 155.4 3.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.857 0.361 . . . . 0.0 110.91 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 53.04 59.0 4.75 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.699 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.5 ptt-85 -87.12 -16.28 35.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.974 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.77 -29.15 71.28 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.218 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.41 48.12 0.01 OUTLIER Glycine 0 CA--C 1.516 0.134 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.037 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.59 168.62 21.83 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.737 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.435 0.117 . . . . 0.0 111.276 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 N-CA-C 112.529 -0.228 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m 51.98 53.43 12.57 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.277 0.56 . . . . 0.0 111.072 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 101.31 27.6 7.19 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.548 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.92 -173.83 0.11 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.156 0.503 . . . . 0.0 111.124 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -153.92 103.85 0.24 Allowed Glycine 0 C--N 1.334 0.443 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.62 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.08 141.34 52.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.004 0.431 . . . . 0.0 110.977 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -53.88 -28.67 37.7 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.953 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -72.58 -63.81 1.08 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.839 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.7 t -55.06 -35.89 65.0 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.099 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -65.53 -47.16 76.87 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.399 0.437 . . . . 0.0 110.925 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.79 -26.66 62.51 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.04 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 21.5 mtm -71.07 -44.76 65.07 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -36.4 82.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.489 0.661 . . . . 0.0 111.073 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -72.14 -28.58 63.34 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.964 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -117.31 49.02 1.24 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.789 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -26.87 68.72 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 123.44 0.462 . . . . 0.0 110.523 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.95 -46.89 13.4 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -118.2 74.02 10.46 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 121.796 0.808 . . . . 0.0 111.484 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.691 ' HA ' HG23 ' A' ' 22' ' ' VAL . 50.2 Cg_endo -69.9 -7.44 21.11 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.003 2.469 . . . . 0.0 112.446 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.46 -14.05 60.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.89 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.36 0.27 26.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.974 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.691 HG23 ' HA ' ' A' ' 19' ' ' PRO . 29.0 t -55.28 -42.51 66.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 O-C-N 123.597 0.561 . . . . 0.0 110.611 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.16 -48.99 61.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.776 0.322 . . . . 0.0 110.693 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.57 -34.4 67.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.847 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.67 -43.92 45.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.905 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.75 -40.96 89.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.165 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.23 -38.44 58.02 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 121.02 0.438 . . . . 0.0 110.849 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.38 -52.37 10.93 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.599 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -54.63 -54.66 38.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.293 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -61.12 -30.12 70.18 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.692 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -65.16 98.59 0.32 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.268 0.556 . . . . 0.0 110.609 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -88.09 42.97 1.09 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.682 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -15.95 27.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.678 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.43 -68.89 1.5 Allowed Glycine 0 C--O 1.239 0.439 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.33 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 55.94 27.42 Favored Glycine 0 C--N 1.319 -0.384 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.27 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -157.58 -173.79 26.46 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.673 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.7 t70 . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.849 0.357 . . . . 0.0 110.878 179.819 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.376 -0.29 . . . . 0.0 112.376 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.0 m 54.84 71.37 0.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.791 0.329 . . . . 0.0 111.045 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 164.58 143.29 3.66 Favored Glycine 0 C--O 1.238 0.376 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.19 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.39 139.71 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.866 0.365 . . . . 0.0 110.693 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -131.87 129.68 5.7 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.423 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.8 p -62.24 146.72 50.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 110.897 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 81.4 m -56.72 -26.39 56.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -73.78 -64.56 0.97 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.04 -38.51 65.28 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.823 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.35 -47.11 74.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.961 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 m -67.87 -28.34 67.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.092 0.472 . . . . 0.0 111.005 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.3 mtm -71.2 -42.82 68.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.528 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -66.62 -35.88 81.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.913 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -26.03 59.31 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.031 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -117.85 43.99 2.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.185 0.517 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.04 -26.1 68.12 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.05 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -87.6 -26.68 22.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.073 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -139.72 69.88 37.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.806 0.812 . . . . 0.0 110.599 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.759 ' HA ' HG23 ' A' ' 22' ' ' VAL . 52.4 Cg_endo -69.78 -5.84 17.17 Favored 'Trans proline' 0 N--CA 1.475 0.384 0 C-N-CA 122.611 2.208 . . . . 0.0 112.343 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -71.2 -17.77 62.51 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.433 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -106.13 8.58 32.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.528 0.68 . . . . 0.0 111.166 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.759 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.1 t -54.78 -44.88 73.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -51.31 -47.82 62.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.21 0.528 . . . . 0.0 111.308 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -56.62 -35.73 68.64 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.049 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 30.8 t -74.74 -45.22 45.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.2 t -64.28 -41.06 91.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.198 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -38.69 61.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.492 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -74.9 -52.38 11.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.18 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.63 -54.84 36.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.246 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -61.61 -67.16 0.44 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.655 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.86 93.4 0.55 Allowed 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.816 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptp85 -87.95 43.1 1.09 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.827 0.346 . . . . 0.0 110.922 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.63 -16.49 60.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.343 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -88.66 -123.55 2.14 Favored Glycine 0 CA--C 1.509 -0.316 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.822 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -147.64 -116.73 0.93 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.617 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -59.12 143.56 45.76 Favored Glycine 0 CA--C 1.508 -0.404 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.532 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.325 -0.496 0 O-C-N 122.665 -0.315 . . . . 0.0 110.755 -179.859 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.432 0 N-CA-C 112.259 -0.336 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.1 m -89.28 -70.08 0.68 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.961 0.41 . . . . 0.0 111.171 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.57 -96.69 0.12 Allowed Glycine 0 C--O 1.229 -0.164 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.332 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.68 175.42 5.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.586 0.193 . . . . 0.0 111.07 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.66 136.26 0.05 OUTLIER Glycine 0 CA--C 1.526 0.77 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.403 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -75.33 -177.35 3.49 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 120.865 0.364 . . . . 0.0 110.67 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 88.9 m -63.66 -16.33 60.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.095 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.544 ' HD2' HG21 ' A' ' 26' ' ' VAL . 2.1 tpt180 -75.68 -63.29 1.33 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.978 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.55 -36.96 56.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.79 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -67.39 -51.77 47.89 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.379 0.424 . . . . 0.0 111.035 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 m -65.24 -25.19 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.487 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 55.8 mtp -72.39 -43.01 64.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.122 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtt-85 -66.75 -36.28 82.08 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.86 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -73.83 -26.27 60.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.077 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -118.04 43.82 2.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.819 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -65.67 -25.15 67.21 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -87.96 -26.07 22.86 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 121.196 0.522 . . . . 0.0 110.676 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -140.76 69.62 30.41 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 122.284 1.04 . . . . 0.0 111.31 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.766 ' HA ' HG23 ' A' ' 22' ' ' VAL . 53.9 Cg_endo -69.28 -5.46 15.96 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.697 2.265 . . . . 0.0 112.225 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -71.68 -18.17 62.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.481 0.488 . . . . 0.0 111.08 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -105.75 8.24 32.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.663 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.766 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.5 t -53.85 -45.8 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 121.363 0.602 . . . . 0.0 111.228 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -44.74 62.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.947 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.65 -35.78 73.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.39 0.614 . . . . 0.0 111.325 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.2 t -75.72 -44.18 43.26 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.946 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.544 HG21 ' HD2' ' A' ' 8' ' ' ARG . 72.9 t -64.0 -41.75 93.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.219 0.533 . . . . 0.0 111.277 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -38.22 59.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.059 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -74.77 -52.37 11.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.011 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.4 t -55.17 -55.05 35.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.907 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 -59.99 -64.73 0.84 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.063 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -65.85 178.75 1.0 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.363 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 mtt85 52.67 47.61 24.31 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.971 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -95.26 24.83 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.045 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -88.89 -38.74 6.77 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.331 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.2 -52.38 0.53 Allowed Glycine 0 C--O 1.226 -0.362 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.45 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 139.61 -144.96 15.84 Favored Glycine 0 C--O 1.222 -0.648 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.944 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.408 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.535 0 N-CA-C 112.321 -0.311 . . . . 0.0 112.321 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.62 166.21 12.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.405 0.621 . . . . 0.0 111.004 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.75 -114.31 0.74 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.756 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -103.88 168.88 8.84 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.693 0.282 . . . . 0.0 110.829 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -174.06 158.5 27.28 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.899 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.2 144.21 20.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.599 -0.354 . . . . 0.0 110.796 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.6 m -59.72 -26.11 65.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.221 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -72.44 -63.84 1.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.491 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.4 t -55.31 -37.13 66.98 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.562 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.63 -47.14 76.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 111.143 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -69.61 -28.57 66.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.296 0.57 . . . . 0.0 110.795 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.7 mtt -68.49 -46.25 70.19 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.215 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -36.2 83.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.847 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.0 -25.92 60.17 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.907 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -117.79 40.04 3.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.823 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.48 68.32 Favored 'General case' 0 C--O 1.239 0.548 0 O-C-N 123.176 0.297 . . . . 0.0 110.421 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -85.31 -25.97 26.86 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.327 0.392 . . . . 0.0 110.708 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -139.88 70.66 36.15 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 121.722 0.772 . . . . 0.0 111.232 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.674 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.7 Cg_endo -69.53 -7.0 19.85 Favored 'Trans proline' 0 N--CA 1.475 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.232 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -79.08 10.18 3.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.656 0.265 . . . . 0.0 111.065 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -137.19 7.58 2.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.343 0.592 . . . . 0.0 110.952 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.674 HG23 ' HA ' ' A' ' 19' ' ' PRO . 51.7 t -56.53 -40.93 71.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.637 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -51.55 -45.39 63.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.29 -35.7 72.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.089 0.471 . . . . 0.0 110.401 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.8 t -75.52 -44.57 42.94 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.923 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -64.21 -41.16 91.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.886 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.4 t -52.5 -38.12 58.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.311 0.576 . . . . 0.0 110.935 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -75.0 -53.07 9.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.755 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -54.68 -55.06 33.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.812 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -60.17 -30.4 69.3 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.015 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 159.09 24.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.553 0.692 . . . . 0.0 110.221 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.62 3.93 34.64 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.296 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.47 -16.71 25.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.68 -109.08 0.2 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.327 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.93 -61.24 0.09 OUTLIER Glycine 0 C--O 1.227 -0.283 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.841 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.37 132.16 7.49 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.224 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.0 t0 . . . . . 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 110.607 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.464 0 N-CA-C 112.379 -0.288 . . . . 0.0 112.379 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.46 179.32 7.44 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 120.955 0.407 . . . . 0.0 111.139 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.97 -171.17 47.75 Favored Glycine 0 N--CA 1.458 0.154 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.335 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -150.72 72.75 1.09 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.664 0.268 . . . . 0.0 111.176 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.82 115.86 0.34 Allowed Glycine 0 CA--C 1.511 -0.205 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.336 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.7 p -72.89 158.79 34.84 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.393 -0.475 . . . . 0.0 110.62 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.3 m -58.93 -31.34 68.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.927 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -65.27 -63.72 1.03 Allowed 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.982 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -40.3 64.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -66.14 -47.97 72.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.575 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 m -64.67 -33.28 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.791 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 30.1 mtm -66.77 -44.42 81.4 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.581 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mtp85 -66.81 -36.02 81.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.916 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -74.02 -27.82 61.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.793 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -118.24 35.53 4.71 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 123.465 0.478 . . . . 0.0 110.577 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -60.14 -26.41 66.26 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 123.458 0.474 . . . . 0.0 110.626 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -83.7 -25.87 30.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.03 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -139.32 71.49 39.24 Favored Pre-proline 0 N--CA 1.455 -0.208 0 CA-C-O 121.765 0.793 . . . . 0.0 111.07 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.78 ' HA ' HG23 ' A' ' 22' ' ' VAL . 50.2 Cg_endo -70.31 -4.97 15.48 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.033 2.489 . . . . 0.0 112.114 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -76.01 -0.61 22.28 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.604 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -129.61 12.94 5.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.692 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.78 HG23 ' HA ' ' A' ' 19' ' ' PRO . 24.4 t -59.81 -42.08 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.649 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -51.74 -48.47 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.338 0.399 . . . . 0.0 110.789 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.52 -35.28 63.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.095 0.474 . . . . 0.0 111.081 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.0 t -75.62 -45.55 36.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.339 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.66 -40.19 87.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.389 0.614 . . . . 0.0 111.533 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.02 -42.24 80.01 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.067 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.22 -52.42 10.94 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.565 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.8 t -54.0 -43.76 70.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -64.9 -64.08 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.786 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.3 ptt180 -54.81 137.9 43.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.141 0.496 . . . . 0.0 110.65 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -85.37 3.88 37.84 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.671 0.748 . . . . 0.0 111.222 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 ptt180 -94.51 41.13 1.09 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.924 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -108.07 -75.39 0.9 Allowed Glycine 0 CA--C 1.509 -0.317 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.205 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 148.05 -60.32 0.45 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.645 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 141.16 -178.91 19.88 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.339 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 40.2 t0 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 121.143 0.497 . . . . 0.0 110.482 -179.67 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.299 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -73.69 157.12 37.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.93 0.395 . . . . 0.0 110.95 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.59 -174.19 45.83 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.665 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 53.27 75.24 0.26 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.909 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -106.63 -87.23 1.94 Allowed Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.266 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.35 148.81 25.06 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 122.306 -0.526 . . . . 0.0 111.167 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.8 m -56.82 -27.67 60.38 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 120.643 0.259 . . . . 0.0 110.307 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.6 -63.89 1.07 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.919 0.39 . . . . 0.0 111.209 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -54.89 -36.84 65.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.799 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -65.76 -45.93 80.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.865 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.6 m -72.28 -26.42 61.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.691 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 mtm -71.84 -44.78 63.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.899 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -67.45 -36.29 80.9 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.018 0.437 . . . . 0.0 110.74 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.9 ttt-85 -72.12 -26.11 62.0 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.906 0.384 . . . . 0.0 111.174 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.91 49.13 1.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.869 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.7 -26.28 68.31 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.547 0.53 . . . . 0.0 111.055 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -82.46 -40.04 21.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -127.17 74.31 77.09 Favored Pre-proline 0 C--N 1.329 -0.289 0 O-C-N 123.788 0.68 . . . . 0.0 110.91 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.704 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.8 Cg_endo -69.68 -8.09 22.7 Favored 'Trans proline' 0 C--N 1.337 -0.072 0 C-N-CA 122.921 2.414 . . . . 0.0 112.27 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -14.22 60.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.048 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.23 0.03 26.85 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.568 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 19' ' ' PRO . 31.0 t -54.35 -42.23 56.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.429 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -50.79 -48.52 59.53 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.136 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.16 -34.94 68.96 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.595 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 t -74.8 -44.82 47.37 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.064 0.459 . . . . 0.0 110.735 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.4 t -64.82 -41.78 93.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.088 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.33 -38.02 57.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.116 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -74.91 -52.89 10.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.1 t -54.96 -54.24 45.43 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.433 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -60.95 -65.67 0.66 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.527 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -65.59 108.38 2.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.011 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -86.69 13.58 8.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.024 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.82 13.93 1.91 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.677 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -102.95 -19.94 12.16 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.396 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -152.18 -63.76 0.01 OUTLIER Glycine 0 C--O 1.226 -0.403 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.14 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 150.2 171.18 18.31 Favored Glycine 0 C--O 1.238 0.386 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.724 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.988 0.423 . . . . 0.0 110.836 179.874 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.454 0 CA-C-O 120.904 0.169 . . . . 0.0 112.836 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 t 61.92 -177.75 0.13 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 122.053 -0.675 . . . . 0.0 110.741 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 100.77 72.47 0.99 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.312 -0.471 . . . . 0.0 112.403 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 45.23 -164.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.861 -0.2 . . . . 0.0 111.051 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -174.66 121.26 0.82 Allowed Glycine 0 C--O 1.23 -0.124 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.277 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -75.4 -177.55 3.62 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.91 0.386 . . . . 0.0 110.707 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.7 m -63.37 -16.52 60.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.865 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -73.38 -64.17 1.04 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.028 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -55.38 -36.06 65.96 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -65.62 -46.07 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.263 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -73.02 -25.44 60.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.567 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.2 mtm -71.76 -45.23 62.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.203 0.525 . . . . 0.0 111.085 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmm-85 -68.13 -34.96 77.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -72.24 -27.04 62.26 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.759 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -118.74 49.77 1.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.32 -26.64 68.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.345 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -82.14 -39.64 22.98 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -127.3 74.77 77.38 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-O 121.744 0.783 . . . . 0.0 111.002 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.695 ' HA ' HG23 ' A' ' 22' ' ' VAL . 47.7 Cg_endo -70.39 -7.4 21.15 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.746 2.297 . . . . 0.0 112.067 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 9.8 t-105 -75.82 -14.84 60.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.425 0.631 . . . . 0.0 111.005 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.35 0.32 26.88 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.398 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.695 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.3 t -54.49 -42.22 58.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.009 0.433 . . . . 0.0 111.399 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -51.17 -48.12 61.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.954 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.32 -34.63 68.93 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.794 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.2 t -75.38 -44.33 45.47 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.264 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.85 -41.37 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.358 0.599 . . . . 0.0 111.45 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -55.29 -39.82 70.32 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.805 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -75.03 -51.17 14.23 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.0 0.429 . . . . 0.0 111.071 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.2 t -55.3 -54.31 45.13 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.8 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 -61.7 -32.36 72.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.096 0.474 . . . . 0.0 110.793 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 143.56 50.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.712 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 62.17 55.46 2.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.039 0.447 . . . . 0.0 110.563 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -94.8 38.47 1.12 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.857 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.1 -41.33 1.08 Allowed Glycine 0 C--O 1.236 0.241 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.226 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -63.42 -101.12 0.01 OUTLIER Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.195 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -88.26 -144.26 9.62 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.501 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.3 t0 . . . . . 0 C--N 1.332 -0.17 0 CA-C-O 120.872 0.368 . . . . 0.0 111.065 179.871 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 N-CA-C 112.826 -0.11 . . . . 0.0 112.826 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.9 p -159.86 163.7 34.18 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 121.05 0.452 . . . . 0.0 111.067 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 149.76 144.85 4.02 Favored Glycine 0 C--O 1.221 -0.718 0 C-N-CA 121.247 -0.501 . . . . 0.0 112.466 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 60.39 99.74 0.03 OUTLIER 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.795 0.331 . . . . 0.0 111.012 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -127.95 115.18 2.03 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.763 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.48 143.36 19.86 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.98 0.419 . . . . 0.0 111.024 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 65.2 m -57.33 -27.76 62.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -64.45 -63.99 0.99 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.015 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 m -57.36 -36.01 70.67 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.52 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -67.84 -43.83 78.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.8 m -72.68 -31.15 64.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.742 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.2 mtm -67.49 -46.96 71.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.569 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -65.72 -35.57 81.11 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.136 0.493 . . . . 0.0 111.215 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -73.07 -25.64 60.97 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -119.13 49.48 1.33 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.498 0.499 . . . . 0.0 110.989 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -65.36 -25.94 67.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.032 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -82.29 -34.97 28.44 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.927 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -133.55 73.36 72.9 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.692 0.758 . . . . 0.0 110.68 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.692 ' HA ' HG23 ' A' ' 22' ' ' VAL . 54.0 Cg_endo -69.67 -7.76 21.86 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.94 2.427 . . . . 0.0 112.15 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -75.45 -15.1 60.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.237 0.541 . . . . 0.0 110.972 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.66 -0.87 27.07 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.692 HG23 ' HA ' ' A' ' 19' ' ' PRO . 35.4 t -54.16 -35.9 30.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.105 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -54.34 43.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.54 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -55.03 -32.56 61.94 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.3 t -75.35 -44.65 43.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.01 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.8 t -65.48 -40.6 88.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.722 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -56.88 -42.48 79.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 110.526 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -75.22 -52.44 10.91 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.816 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.1 t -55.05 -42.74 73.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.43 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -62.54 1.48 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.806 0.336 . . . . 0.0 110.917 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -54.76 139.34 39.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.901 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 mtt85 60.53 58.29 2.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.737 0.303 . . . . 0.0 111.002 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.97 42.23 1.1 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.125 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.85 -126.94 1.28 Allowed Glycine 0 N--CA 1.459 0.214 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.469 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -84.57 -73.41 1.27 Allowed Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.418 -179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.5 -135.42 12.15 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.551 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.659 0.266 . . . . 0.0 110.825 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 112.755 -0.138 . . . . 0.0 112.755 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.5 m 61.49 85.48 0.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.819 0.343 . . . . 0.0 111.28 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.06 -97.31 0.07 OUTLIER Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.2 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.43 -174.97 0.16 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.97 0.414 . . . . 0.0 110.532 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.44 141.53 3.9 Favored Glycine 0 CA--C 1.512 -0.147 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.634 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -55.46 164.18 1.07 Allowed 'General case' 0 C--O 1.243 0.735 0 CA-C-O 120.992 0.425 . . . . 0.0 110.847 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.3 -25.38 66.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.4 0.619 . . . . 0.0 111.006 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -64.5 0.85 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.8 t -55.61 -34.08 64.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.184 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -65.2 -46.16 81.82 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.902 0.382 . . . . 0.0 110.715 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.5 m -75.99 -25.94 56.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 41.3 mtp -63.88 -55.4 23.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.831 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -65.15 -38.72 91.5 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.56 0.537 . . . . 0.0 110.882 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 -63.94 -25.43 68.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.159 0.504 . . . . 0.0 110.919 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -120.38 50.2 1.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.81 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -65.28 -25.85 67.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.946 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -83.89 -28.89 27.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.973 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -141.49 74.18 23.95 Favored Pre-proline 0 C--O 1.232 0.172 0 CA-C-O 121.732 0.777 . . . . 0.0 110.569 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.702 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.2 Cg_endo -69.4 -7.77 21.83 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.778 2.319 . . . . 0.0 112.425 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -75.36 -15.16 60.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.77 0.62 28.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.085 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.702 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.0 t -54.39 -38.22 39.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.085 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.71 -55.21 28.16 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.639 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.22 -32.63 56.36 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 123.654 0.596 . . . . 0.0 111.141 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.8 t -75.37 -45.19 40.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.646 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.95 -42.12 93.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.995 0.426 . . . . 0.0 110.996 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.6 t -51.29 -38.46 52.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.353 0.597 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -75.51 -52.46 10.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.676 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.4 t -54.89 -55.11 34.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.788 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.72 -66.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 110.785 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.0 mmt-85 -67.45 -174.93 0.44 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.951 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -173.89 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.712 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.06 -16.02 57.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.122 0.487 . . . . 0.0 111.09 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -110.6 -135.16 6.87 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.691 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -163.24 37.94 0.33 Allowed Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.998 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.59 -159.38 13.89 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.219 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 . . . . . 0 C--N 1.332 -0.171 0 O-C-N 122.614 -0.344 . . . . 0.0 110.622 -179.439 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.705 0 CA-C-O 120.316 -0.158 . . . . 0.0 112.746 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.87 -170.75 3.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.913 0.387 . . . . 0.0 110.879 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 71.38 31.82 65.57 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.324 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -126.46 143.93 51.02 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 122.318 -0.519 . . . . 0.0 110.867 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -139.97 69.88 0.46 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.813 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 p -70.41 162.76 28.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.982 0.42 . . . . 0.0 110.476 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 m -58.91 -28.91 66.65 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.943 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.22 -64.26 0.96 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.723 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.3 t -57.6 -34.46 69.28 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.108 0.48 . . . . 0.0 110.636 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -68.77 -44.8 72.91 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.63 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.9 m -71.6 -32.0 67.54 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.389 0.614 . . . . 0.0 111.02 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 mtm -67.85 -46.52 71.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -65.98 -35.77 81.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.862 0.363 . . . . 0.0 111.099 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ttt85 -71.76 -28.29 63.54 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.52 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -117.51 50.83 1.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.139 0.495 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.61 -26.16 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.607 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -82.8 -42.58 17.73 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.95 0.405 . . . . 0.0 110.745 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -124.06 74.6 58.12 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-O 121.812 0.815 . . . . 0.0 110.739 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.693 ' HA ' HG23 ' A' ' 22' ' ' VAL . 51.0 Cg_endo -70.01 -8.4 23.52 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.801 2.334 . . . . 0.0 112.116 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 1.8 m0 -75.34 -14.63 60.49 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.013 0.435 . . . . 0.0 111.283 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.6 -0.6 27.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.126 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.693 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.9 t -54.05 -41.65 51.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.517 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -51.76 -48.07 63.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.124 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -56.96 -35.73 69.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.547 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.1 t -74.89 -44.52 48.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.646 0.26 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.3 -40.24 87.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.046 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t -57.56 -46.83 83.46 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.038 0.447 . . . . 0.0 110.773 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.33 -49.42 19.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.9 t -54.52 -46.31 73.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.726 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.92 -64.03 0.97 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.803 -179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 155.56 7.21 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.059 -179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -158.34 71.79 0.59 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.863 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -142.69 13.84 1.93 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.804 0.335 . . . . 0.0 111.112 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -109.18 -73.02 0.76 Allowed Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.847 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.6 -67.55 0.8 Allowed Glycine 0 CA--C 1.519 0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.223 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 89.53 -176.37 43.09 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.4 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-O 120.617 0.246 . . . . 0.0 111.087 -179.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.509 0 N-CA-C 112.045 -0.422 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.6 t 58.1 66.15 1.16 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.121 0.486 . . . . 0.0 111.041 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 157.81 123.07 0.73 Allowed Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.353 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -143.28 129.13 19.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.61 0.243 . . . . 0.0 111.032 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -148.8 -170.85 16.98 Favored Glycine 0 CA--C 1.507 -0.406 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.675 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.32 133.48 11.59 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.492 0.187 . . . . 0.0 111.146 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 66.3 m -55.73 -26.09 43.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.086 0.469 . . . . 0.0 111.192 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -64.54 1.02 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -54.4 -37.87 65.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.937 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -66.84 -47.1 73.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.114 0.483 . . . . 0.0 110.806 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.1 m -67.12 -35.23 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.7 mtm -65.57 -41.48 92.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.502 0.668 . . . . 0.0 111.142 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -64.5 -39.11 93.18 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.682 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -74.58 -26.72 60.12 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.01 0.434 . . . . 0.0 110.633 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -117.31 45.48 1.89 Allowed 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.02 -26.14 68.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.951 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -89.62 -38.57 13.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.533 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -123.32 68.09 37.68 Favored Pre-proline 0 N--CA 1.451 -0.391 0 CA-C-O 121.787 0.804 . . . . 0.0 111.028 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.76 ' HA ' HG23 ' A' ' 22' ' ' VAL . 54.5 Cg_endo -69.64 -5.17 15.49 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.665 2.243 . . . . 0.0 112.534 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 5.4 m0 -70.6 -17.94 62.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.724 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -105.81 7.66 32.45 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.291 0.369 . . . . 0.0 110.446 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.76 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.4 t -54.22 -44.78 66.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.932 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -53.65 46.37 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.561 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -55.16 -32.73 62.36 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.041 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -74.74 -45.18 45.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.145 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.6 t -65.16 -41.38 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-O 121.676 0.751 . . . . 0.0 111.279 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.47 -38.19 58.82 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.698 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -75.53 -51.87 11.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.906 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.6 t -54.85 -55.51 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.392 0.615 . . . . 0.0 110.996 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -61.26 -66.34 0.55 Allowed 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.33 -173.42 0.41 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.295 0.569 . . . . 0.0 110.499 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 52.57 34.53 15.84 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.396 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -76.42 -16.47 59.69 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.067 0.46 . . . . 0.0 110.978 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -52.21 -54.72 25.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.165 -0.54 . . . . 0.0 112.179 -179.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.61 -106.17 0.2 Allowed Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.944 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.09 -164.57 42.53 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.575 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.2 t70 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.843 0.354 . . . . 0.0 110.626 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.75 149.55 37.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.757 0.313 . . . . 0.0 111.235 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.77 -146.09 44.95 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.287 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -133.01 146.15 51.5 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 120.684 0.278 . . . . 0.0 110.937 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.99 133.01 2.15 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.532 -0.842 . . . . 0.0 112.411 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.84 148.85 24.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.973 0.416 . . . . 0.0 111.055 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.8 m -55.87 -26.35 46.67 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.82 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -73.54 -64.7 0.94 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.889 0.376 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -53.65 -38.1 63.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.631 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -65.82 -48.33 72.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.4 m -67.9 -29.48 68.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.0 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.75 -47.11 70.19 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.223 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -65.11 -35.88 82.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -73.13 -27.12 61.5 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.953 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -117.93 41.18 2.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.921 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -64.24 -25.11 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.923 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -84.93 -25.43 27.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -140.79 71.52 29.81 Favored Pre-proline 0 N--CA 1.453 -0.295 0 CA-C-O 121.622 0.725 . . . . 0.0 111.177 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.689 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.8 Cg_endo -69.56 -6.22 17.96 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.534 2.156 . . . . 0.0 112.534 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -79.23 10.59 3.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.769 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -138.68 8.34 2.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.472 -179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.689 HG23 ' HA ' ' A' ' 19' ' ' PRO . 47.5 t -57.97 -40.73 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 121.044 0.449 . . . . 0.0 111.367 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -51.4 -48.43 62.62 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.624 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -56.2 -34.69 66.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.943 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.5 t -75.06 -44.16 49.16 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.266 0.555 . . . . 0.0 111.132 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -64.9 -41.71 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.805 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.0 t -52.01 -37.71 54.32 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.442 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -74.95 -52.71 10.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.394 0.616 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.7 t -54.43 -55.77 25.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.862 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -60.0 -35.13 74.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.868 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.67 157.17 5.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.446 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 33.2 mtt180 54.55 65.33 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.878 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -16.61 42.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.769 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -162.02 174.55 38.5 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.243 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 172.8 -96.77 0.11 Allowed Glycine 0 C--O 1.222 -0.596 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.489 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -98.28 170.88 25.01 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.246 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.69 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.685 0 N-CA-C 112.27 -0.332 . . . . 0.0 112.27 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.4 t -154.95 87.54 1.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.815 0.341 . . . . 0.0 111.133 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.68 -79.81 1.26 Allowed Glycine 0 C--N 1.329 0.14 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -114.69 -179.94 3.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.671 0.272 . . . . 0.0 111.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.0 140.06 10.17 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.415 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.57 145.31 21.29 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.768 0.318 . . . . 0.0 110.712 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 76.5 m -56.24 -27.48 55.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.12 0.486 . . . . 0.0 110.715 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -73.49 -63.77 1.13 Allowed 'General case' 0 C--O 1.241 0.607 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.931 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -54.43 -38.03 65.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.224 0.535 . . . . 0.0 110.778 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -64.41 -47.07 80.56 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.736 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.458 ' HB3' HG13 ' A' ' 22' ' ' VAL . 52.1 m -71.42 -24.8 62.1 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.747 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 17.4 mtm -72.99 -43.68 61.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.218 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -68.74 -35.9 77.7 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 123.672 0.607 . . . . 0.0 111.032 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -71.6 -28.65 63.95 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.595 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -117.72 48.31 1.4 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.973 0.416 . . . . 0.0 111.054 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -64.11 -26.92 68.75 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -85.98 -27.35 24.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.557 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -138.7 69.91 44.42 Favored Pre-proline 0 C--O 1.231 0.107 0 CA-C-O 121.895 0.855 . . . . 0.0 110.888 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.725 ' HA ' HG23 ' A' ' 22' ' ' VAL . 48.2 Cg_endo -70.17 -6.46 18.85 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.923 2.415 . . . . 0.0 111.793 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -74.87 -14.63 60.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.647 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.42 0.66 27.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.052 0.453 . . . . 0.0 110.912 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.725 HG23 ' HA ' ' A' ' 19' ' ' PRO . 25.4 t -55.53 -34.06 34.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.068 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.35 -55.84 24.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.7 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.03 -31.35 61.01 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.576 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.7 t -75.7 -44.95 39.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.974 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.6 t -65.17 -41.13 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.57 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.4 t -52.49 -37.9 58.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.865 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.2 -52.67 10.36 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.834 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.3 t -54.6 -55.18 32.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.028 0.442 . . . . 0.0 110.634 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -60.66 -30.11 69.7 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.672 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.41 111.53 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.465 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 54.14 57.27 6.07 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.485 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -75.38 -16.2 60.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.857 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.89 -35.42 90.77 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 121.15 -0.548 . . . . 0.0 112.04 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.59 68.17 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.642 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.9 173.31 25.5 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.514 -0.85 . . . . 0.0 112.617 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 C--O 1.243 0.75 0 CA-C-O 121.023 0.44 . . . . 0.0 110.979 -179.498 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 CA-C-O 121.049 0.249 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m 60.76 75.28 0.42 Allowed 'General case' 0 C--O 1.235 0.34 0 O-C-N 122.666 -0.314 . . . . 0.0 111.245 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.94 -103.52 0.18 Allowed Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.02 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.88 139.31 53.01 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.803 0.335 . . . . 0.0 110.753 -179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -139.49 -84.78 0.11 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.582 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.61 145.02 20.99 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.222 0.534 . . . . 0.0 110.824 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.8 m -59.13 -27.44 65.63 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.12 -63.83 1.1 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.924 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.9 m -53.39 -39.34 64.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.057 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.98 -48.05 80.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.983 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB3' HG13 ' A' ' 22' ' ' VAL . 50.6 m -70.84 -24.9 62.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.707 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.9 mtm -72.63 -44.17 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.886 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -69.1 -35.25 76.25 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.772 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -72.01 -28.75 63.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.643 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -117.42 48.51 1.34 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -27.34 69.14 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.795 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.66 -27.41 25.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 0.0 110.839 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.98 69.53 42.41 Favored Pre-proline 0 C--O 1.235 0.337 0 CA-C-O 121.51 0.671 . . . . 0.0 110.886 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.717 ' HA ' HG23 ' A' ' 22' ' ' VAL . 53.5 Cg_endo -69.51 -6.59 18.85 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.908 2.405 . . . . 0.0 112.464 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -74.39 -15.02 60.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.772 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -105.81 0.84 26.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.894 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.717 HG23 ' HA ' ' A' ' 19' ' ' PRO . 27.7 t -55.03 -34.74 32.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -55.09 34.85 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.701 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -54.83 -31.9 59.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.522 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.8 t -75.98 -44.4 39.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 123.589 0.556 . . . . 0.0 111.062 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.8 t -65.6 -41.31 90.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.909 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -37.67 57.79 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.899 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -75.23 -52.58 10.56 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.325 0.583 . . . . 0.0 111.186 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.3 t -55.07 -54.89 37.35 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.955 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ttm180 -59.73 -35.0 73.66 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.921 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.0 156.05 9.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.928 0.394 . . . . 0.0 110.73 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -160.31 27.01 0.16 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.162 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -81.51 -15.63 54.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -105.69 -166.08 23.45 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.454 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.9 51.19 0.02 OUTLIER Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.433 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -84.23 -145.95 7.22 Favored Glycine 0 CA--C 1.509 -0.326 0 C-N-CA 120.285 -0.96 . . . . 0.0 112.373 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.946 0.403 . . . . 0.0 110.628 -179.733 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 N-CA-C 112.465 -0.254 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.4 m -148.92 89.39 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.085 0.469 . . . . 0.0 110.904 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.28 127.57 8.11 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.458 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.83 102.75 11.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.115 0.483 . . . . 0.0 110.833 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -113.27 -103.06 2.58 Favored Glycine 0 C--N 1.337 0.609 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.37 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.59 146.2 22.07 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.662 0.268 . . . . 0.0 111.033 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.0 -26.92 68.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.576 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HD3' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -74.26 -64.32 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.202 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 t -52.13 -36.49 51.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.063 -179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -67.29 -51.43 52.83 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.127 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB3' HG13 ' A' ' 22' ' ' VAL . 51.2 m -64.51 -29.01 70.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.9 mtp -68.92 -47.19 66.37 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.806 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -65.62 -36.41 83.64 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.676 0.61 . . . . 0.0 110.94 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ttt-85 -71.82 -26.26 62.32 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -117.98 48.95 1.3 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.48 -25.65 67.58 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.101 0.477 . . . . 0.0 110.746 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -83.17 -30.0 28.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.609 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -140.14 74.41 30.55 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.49 0.662 . . . . 0.0 110.603 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.704 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.5 Cg_endo -69.64 -7.93 22.28 Favored 'Trans proline' 0 N--CA 1.474 0.327 0 C-N-CA 122.721 2.281 . . . . 0.0 112.231 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.33 -14.81 60.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.952 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.98 -0.08 27.22 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.4 t -54.83 -35.0 32.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.34 -54.27 42.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.732 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.12 -32.75 55.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.957 0.408 . . . . 0.0 111.182 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -75.55 -44.71 42.01 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.753 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.55 HG21 ' HD3' ' A' ' 8' ' ' ARG . 68.9 t -65.1 -41.81 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.233 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 t -52.05 -38.5 57.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.958 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -74.46 -52.75 11.1 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.053 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.4 t -54.94 -54.93 36.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.691 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.4 ttm-85 -61.74 -67.64 0.39 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -68.64 -170.73 0.23 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.09 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -170.66 73.58 0.06 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.507 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -94.14 40.52 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.182 0.515 . . . . 0.0 110.823 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -172.83 -102.78 0.16 Allowed Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.754 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -173.98 -42.21 0.05 OUTLIER Glycine 0 C--N 1.334 0.453 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.146 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -138.36 -135.01 3.27 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.228 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.552 0 CA-C-O 121.067 0.46 . . . . 0.0 110.794 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 112.261 -0.335 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 95.6 p -53.15 148.23 8.58 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.456 0.645 . . . . 0.0 110.973 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 146.2 -173.44 26.49 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.218 -179.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.9 mtm-85 -132.12 120.73 22.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.214 0.531 . . . . 0.0 110.906 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.1 57.88 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.526 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.8 155.69 15.64 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.679 0.276 . . . . 0.0 110.846 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 86.8 m -52.83 -35.67 57.51 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.998 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -64.09 -64.28 0.93 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.236 0.541 . . . . 0.0 111.306 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 t -56.52 -36.43 69.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.2 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -67.03 -44.57 79.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.705 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.527 ' HB3' HG13 ' A' ' 22' ' ' VAL . 44.4 m -71.63 -30.79 66.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.801 0.334 . . . . 0.0 111.192 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.8 mtm -69.32 -44.85 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.41 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -68.34 -35.56 77.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.672 -179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -71.79 -25.87 62.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.06 0.457 . . . . 0.0 111.505 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -118.53 49.51 1.28 Allowed 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -64.35 -26.39 68.45 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.19 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.07 -29.9 28.43 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.675 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -141.04 74.25 25.64 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.786 0.803 . . . . 0.0 110.912 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.712 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.3 Cg_endo -70.01 -7.86 22.18 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.554 2.17 . . . . 0.0 111.899 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -75.43 -14.63 60.46 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.761 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.31 0.09 26.73 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.32 -179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.712 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.1 t -54.69 -35.4 32.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.829 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.78 -53.23 51.17 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.255 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.03 -32.35 61.79 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.688 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -75.76 -45.54 35.82 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.258 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 79.4 t -65.14 -40.11 87.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.231 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -53.25 -37.41 62.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -75.34 -55.81 5.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.388 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -53.96 -34.68 60.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.659 0.743 . . . . 0.0 111.337 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.08 -58.02 8.89 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.812 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.17 173.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -86.81 42.56 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 123.537 0.523 . . . . 0.0 111.029 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 ptt85 -75.14 -16.14 60.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.824 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -103.96 -131.72 7.3 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.434 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 178.73 -53.56 0.09 OUTLIER Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.434 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 84.96 141.15 5.33 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.32 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.5 t0 . . . . . 0 C--O 1.236 0.352 0 CA-C-O 120.969 0.414 . . . . 0.0 110.834 179.986 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.392 0 CA-C-O 121.096 0.275 . . . . 0.0 112.426 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -117.22 118.01 31.14 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.226 0.536 . . . . 0.0 110.83 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 163.46 -81.6 0.12 Allowed Glycine 0 CA--C 1.525 0.687 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.644 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.3 mtt-85 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.579 0.228 . . . . 0.0 111.177 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -102.64 128.42 9.54 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.263 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.2 p -67.63 -170.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.27 0.557 . . . . 0.0 110.631 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.2 m -96.6 -25.25 15.67 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.816 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.543 ' HD3' HG21 ' A' ' 26' ' ' VAL . 2.1 tpp180 -73.67 -63.9 1.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.811 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 t -55.65 -36.21 66.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.824 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -66.62 -46.05 77.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.992 0.425 . . . . 0.0 110.64 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.6 m -71.45 -27.87 63.56 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.91 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 mtm -69.65 -45.78 67.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.057 0.456 . . . . 0.0 110.757 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -65.97 -36.13 82.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.815 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ttt85 -73.44 -26.01 60.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.616 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -118.58 48.53 1.43 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.706 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -65.52 -25.58 67.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.744 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -81.99 -34.36 29.71 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.169 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -134.39 73.82 67.93 Favored Pre-proline 0 C--O 1.239 0.54 0 CA-C-O 121.514 0.673 . . . . 0.0 110.633 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.696 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.9 Cg_endo -69.0 -8.76 24.49 Favored 'Trans proline' 0 C--N 1.333 -0.253 0 C-N-CA 123.156 2.571 . . . . 0.0 112.35 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -75.51 -13.99 60.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.65 0.42 26.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.762 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.696 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.6 t -54.69 -36.97 38.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.735 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.61 -54.82 32.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.058 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -54.37 -32.77 57.76 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.957 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -75.29 -44.53 45.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.082 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.543 HG21 ' HD3' ' A' ' 8' ' ' ARG . 69.9 t -65.59 -41.62 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 t -52.2 -38.17 57.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.521 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -75.02 -53.06 9.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 0.0 111.009 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.7 t -54.77 -55.25 32.05 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.415 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -59.87 -31.72 70.04 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.397 0.618 . . . . 0.0 111.286 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.07 149.62 44.65 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.08 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 14.32 7.79 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.748 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.15 25.44 4.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.25 169.81 29.57 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.592 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.05 33.74 10.55 Favored Glycine 0 CA--C 1.511 -0.212 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.382 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.39 172.11 24.88 Favored Glycine 0 N--CA 1.455 -0.092 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.714 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 120.732 0.301 . . . . 0.0 110.678 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.461 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 52.89 42.55 32.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.808 0.337 . . . . 0.0 111.147 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 103.73 40.95 2.24 Favored Glycine 0 CA--C 1.506 -0.486 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.409 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 44.87 -164.36 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.382 0 CA-C-O 121.325 0.583 . . . . 0.0 110.434 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.24 -137.05 23.25 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.337 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.4 148.46 24.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.569 0.223 . . . . 0.0 110.693 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.1 m -61.62 -27.93 69.0 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.671 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -73.95 -63.72 1.16 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.161 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.8 t -52.91 -35.78 58.7 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.801 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -66.25 -52.11 50.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.138 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.4 m -66.65 -25.21 66.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 52.2 mtp -72.49 -45.01 61.46 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.531 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -68.56 -35.92 78.07 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.48 -28.16 63.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -117.8 50.84 1.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.595 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.59 -26.05 67.67 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.592 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -82.05 -44.38 16.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.035 0.445 . . . . 0.0 110.934 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -122.28 74.43 40.67 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.857 0.837 . . . . 0.0 110.952 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.697 ' HA ' HG23 ' A' ' 22' ' ' VAL . 50.4 Cg_endo -70.19 -8.1 22.79 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.823 2.349 . . . . 0.0 111.959 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 1.5 m0 -75.19 -15.12 60.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.127 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.01 0.53 27.77 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.697 HG23 ' HA ' ' A' ' 19' ' ' PRO . 28.2 t -54.6 -43.79 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.246 0.546 . . . . 0.0 110.947 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -51.05 -45.68 61.43 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.151 0.501 . . . . 0.0 111.236 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -58.87 -34.76 71.97 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.408 0.623 . . . . 0.0 110.959 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 24.5 t -75.47 -44.42 44.19 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.138 0.494 . . . . 0.0 110.806 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.7 t -65.37 -41.42 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.045 0.45 . . . . 0.0 111.377 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.1 m -52.04 -37.98 55.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.801 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -75.95 -51.87 11.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.666 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.6 t -55.58 -54.22 46.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.088 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.8 ttm180 -60.67 -31.45 70.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.081 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -62.9 164.43 8.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.937 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.6 mtt-85 55.82 57.4 5.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.923 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -16.37 58.27 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.479 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -68.14 143.16 40.77 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.822 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 153.57 -86.26 0.14 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.658 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -106.94 145.48 15.96 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.473 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 120.59 0.233 . . . . 0.0 110.508 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.9 m -103.52 -179.78 4.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.672 0.236 . . . . 0.0 110.781 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 107.65 81.78 1.4 Allowed Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.337 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.58 62.67 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.948 0.404 . . . . 0.0 111.166 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -112.02 159.14 13.89 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.704 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p -60.49 155.71 17.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.231 0.538 . . . . 0.0 110.815 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.65 -26.3 65.4 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.475 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.39 -64.09 1.02 Allowed 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.766 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -41.66 60.06 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.633 0.254 . . . . 0.0 111.135 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -65.04 -49.32 70.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.765 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.1 m -62.6 -36.45 82.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.232 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.8 mtm -64.17 -47.06 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.652 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -64.74 -36.14 83.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.805 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -74.25 -30.21 62.04 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.207 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -115.71 35.92 4.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.168 0.509 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -60.18 -25.71 65.78 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.025 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -83.01 -25.82 31.82 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.529 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -139.22 71.88 39.44 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.79 ' HA ' HG23 ' A' ' 22' ' ' VAL . 55.4 Cg_endo -69.51 -6.68 19.05 Favored 'Trans proline' 0 C--N 1.334 -0.224 0 C-N-CA 122.532 2.155 . . . . 0.0 112.543 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -76.5 0.2 20.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.838 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -130.26 12.6 5.56 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.921 0.391 . . . . 0.0 110.731 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.79 HG23 ' HA ' ' A' ' 19' ' ' PRO . 24.1 t -59.39 -39.85 80.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.653 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -51.8 63.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.982 0.42 . . . . 0.0 110.978 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.39 -32.49 57.28 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 29.3 t -74.81 -45.32 44.24 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.235 0.54 . . . . 0.0 111.045 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.08 -41.48 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.422 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -37.54 59.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.31 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -75.0 -52.2 11.71 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.442 0.639 . . . . 0.0 111.364 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -54.91 -55.35 31.54 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.958 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -35.79 76.45 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.017 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.98 126.31 24.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.935 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 62.21 71.09 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.183 0.302 . . . . 0.0 110.739 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -92.98 43.81 1.13 Allowed 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 121.19 0.519 . . . . 0.0 110.857 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -129.37 -41.46 0.25 Allowed Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.498 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.18 -21.46 71.96 Favored Glycine 0 C--O 1.226 -0.382 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.766 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 168.02 -163.52 37.22 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.714 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.3 t70 . . . . . 0 C--N 1.327 -0.406 0 CA-C-O 121.08 0.466 . . . . 0.0 110.727 179.559 . . . . . . . . 0 0 . 1 stop_ save_