data_2let_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 2let _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' ' ' MET . . . . . . . . . . . . . 24.3 mmm . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.81 138.05 58.15 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 124.579 1.174 . . . . 0.0 111.837 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -126.46 163.8 22.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 124.319 1.012 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -138.69 -20.97 1.01 Allowed 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.288 -1.778 . . . . 0.0 108.393 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -145.34 163.25 35.13 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.388 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -57.31 -57.65 11.69 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.527 0.68 . . . . 0.0 109.948 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.3 p -54.63 -13.12 0.89 Allowed 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 113.879 -1.51 . . . . 0.0 114.458 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -47.12 -45.72 22.49 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.029 0.831 . . . . 0.0 112.113 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.2 m -89.57 -169.69 2.57 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.991 -1.913 . . . . 0.0 111.471 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mt -75.78 144.97 41.09 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.549 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.03 106.92 0.1 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 124.238 0.962 . . . . 0.0 111.24 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.77 -35.33 1.79 Allowed Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -89.02 172.13 9.34 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.742 0.782 . . . . 0.0 111.301 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.2 m -135.6 167.23 25.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 CA-C-N 113.293 -1.776 . . . . 0.0 107.028 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 t -74.96 98.11 3.51 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.238 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.412 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -49.2 112.06 1.19 Allowed Glycine 0 N--CA 1.494 2.5 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.39 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo -62.19 85.99 0.1 Allowed 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 123.321 2.681 . . . . 0.0 110.675 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -179.76 -35.58 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.198 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.08 -53.46 0.4 Allowed Glycine 0 N--CA 1.48 1.619 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -96.96 162.21 13.49 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.114 -0.543 . . . . 0.0 111.026 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.412 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 63.8 m -51.25 159.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 125.002 1.439 . . . . 0.0 113.205 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.642 0 CA-C-O 117.297 -1.835 . . . . 0.0 111.048 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.967 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.28 129.09 40.39 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.759 0.662 . . . . 0.0 109.796 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER -138.73 133.63 32.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.003 0.814 . . . . 0.0 111.73 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -85.53 -28.03 25.2 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.212 -1.358 . . . . 0.0 109.712 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -132.78 165.73 23.88 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.314 1.009 . . . . 0.0 110.115 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.4 -56.65 17.91 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.0 p -65.64 1.69 1.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.972 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.86 -46.23 51.28 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.659 0.6 . . . . 0.0 111.703 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.1 m -85.04 -178.21 6.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.026 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 143.76 43.62 Favored 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.832 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.68 103.56 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.154 0.909 . . . . 0.0 111.318 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 142.62 -32.39 1.95 Allowed Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -79.85 166.46 21.67 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.965 0.412 . . . . 0.0 109.974 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.3 m -146.39 147.33 18.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.851 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -104.91 118.26 36.09 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 113.44 -1.709 . . . . 0.0 108.736 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.74 178.42 53.3 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -51.57 -24.06 16.25 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.869 1.712 . . . . 0.0 111.372 170.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -60.68 -18.91 56.81 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.323 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.66 5.1 89.76 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -122.35 143.89 49.36 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.336 0.589 . . . . 0.0 110.134 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 73.2 m -64.4 172.5 2.53 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.159 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.677 0 CA-C-O 116.527 -2.263 . . . . 0.0 110.2 179.768 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 46.2 ttm . . . . . 0 N--CA 1.497 1.907 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.32 150.37 33.29 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.367 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.0 155.22 19.6 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.774 0.797 . . . . 0.0 111.183 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -124.12 -19.56 5.56 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.078 -1.874 . . . . 0.0 107.413 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -150.86 154.27 36.9 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -53.81 -44.3 70.08 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.141 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.8 p -79.2 22.46 0.41 Allowed 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.443 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -52.68 -36.37 56.93 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -93.34 -173.78 3.33 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.204 0.94 . . . . 0.0 110.821 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.3 147.43 25.62 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.712 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.21 108.02 0.17 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.695 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.57 -32.78 2.35 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.2 m -81.11 165.18 21.84 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.012 -0.594 . . . . 0.0 110.057 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.55 154.39 12.39 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.269 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -84.34 140.56 31.51 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.89 168.21 24.63 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -52.77 -28.7 39.3 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 122.1 1.867 . . . . 0.0 111.743 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p30 -60.4 -15.72 28.9 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.815 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.58 0.09 79.61 Favored Glycine 0 N--CA 1.481 1.654 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -110.02 163.44 13.57 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -58.41 173.59 0.37 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.874 0.845 . . . . 0.0 111.87 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.45 0 CA-C-O 116.156 -2.469 . . . . 0.0 109.559 179.961 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -72.14 145.44 48.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.473 1.108 . . . . 0.0 110.824 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.73 166.89 10.35 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.558 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -118.6 -26.48 6.15 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 113.403 -1.726 . . . . 0.0 107.21 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -152.34 172.62 16.18 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.827 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.2 -56.91 16.12 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.343 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.7 p -71.77 3.04 4.5 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -48.18 -46.18 34.55 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -78.51 -171.72 2.59 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.6 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 mt -47.9 141.29 5.9 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.92 107.04 0.22 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.614 0.571 . . . . 0.0 110.958 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.58 -21.92 4.19 Favored Glycine 0 N--CA 1.498 2.769 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.236 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.2 m -78.95 173.93 12.05 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.147 0.975 . . . . 0.0 111.532 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.6 m -143.04 170.04 11.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-N 112.765 -2.016 . . . . 0.0 106.564 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 t -114.95 140.38 49.05 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -97.37 160.18 21.26 Favored Glycine 0 CA--C 1.538 1.478 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -52.01 -22.41 14.46 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.919 1.746 . . . . 0.0 112.409 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -14.82 22.65 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.43 -21.46 46.0 Favored Glycine 0 N--CA 1.48 1.584 0 O-C-N 123.687 0.617 . . . . 0.0 112.117 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -102.04 168.62 9.27 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 120.776 0.322 . . . . 0.0 110.783 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 72.1 m -50.55 164.61 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 124.547 1.154 . . . . 0.0 111.207 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 -179.538 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.19 146.24 39.27 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 124.758 1.286 . . . . 0.0 110.754 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.2 p -139.42 -172.8 3.44 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.097 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -158.74 -13.79 0.07 Allowed 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.592 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -131.5 159.72 37.3 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.84 -65.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 82.5 p -72.05 9.13 1.02 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.135 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -50.2 -48.92 54.04 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 123.674 0.609 . . . . 0.0 111.28 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -86.21 -166.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 114.053 -1.431 . . . . 0.0 111.669 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 mp -50.78 134.95 24.6 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.047 0.842 . . . . 0.0 111.91 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.81 109.04 0.21 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 123.659 0.6 . . . . 0.0 112.086 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 131.54 -30.08 3.33 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 25.5 m -81.53 161.51 23.56 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.471 0.653 . . . . 0.0 110.595 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.3 m -132.92 161.88 40.9 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 CA-C-N 113.91 -1.496 . . . . 0.0 108.004 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 t -105.59 119.34 38.87 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.92 172.98 48.53 Favored Glycine 0 N--CA 1.481 1.674 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.76 -20.18 42.02 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.748 1.632 . . . . 0.0 111.099 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.543 HD21 ' H ' ' A' ' 26' ' ' PHE . 7.8 p-10 -66.09 -10.29 39.11 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.183 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.18 -7.53 67.05 Favored Glycine 0 N--CA 1.483 1.781 0 CA-C-O 119.903 -0.387 . . . . 0.0 114.006 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.543 ' H ' HD21 ' A' ' 24' ' ' ASN . 5.5 m-85 -115.1 161.11 18.83 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.466 0.65 . . . . 0.0 110.687 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -68.24 143.31 55.33 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.473 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 115.9 -2.611 . . . . 0.0 107.594 179.628 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 42.1 mtt . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -72.63 146.98 46.23 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.122 0.889 . . . . 0.0 111.255 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.8 p -141.68 162.13 36.24 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.108 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -131.19 -6.55 3.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 113.65 -1.614 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -133.96 153.28 51.88 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.982 0.801 . . . . 0.0 110.876 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.19 -61.1 2.8 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.4 p -69.09 4.46 1.58 Allowed 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.992 -1.458 . . . . 0.0 112.849 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -53.36 -45.44 69.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.519 0.512 . . . . 0.0 110.636 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.2 -174.67 5.18 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 124.188 0.93 . . . . 0.0 110.059 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.31 162.82 21.96 Favored 'General case' 0 N--CA 1.499 2.02 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.95 124.37 8.59 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.118 -1.401 . . . . 0.0 112.262 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.34 -24.8 21.72 Favored Glycine 0 N--CA 1.495 2.621 0 O-C-N 124.574 1.171 . . . . 0.0 112.226 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.3 m -86.37 170.43 12.02 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.718 0.77 . . . . 0.0 112.075 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -146.47 161.13 10.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.493 -1.685 . . . . 0.0 106.52 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.94 101.27 8.52 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.838 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -53.29 115.23 4.46 Favored Glycine 0 N--CA 1.491 2.314 0 CA-C-O 118.374 -1.237 . . . . 0.0 111.318 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -59.53 87.88 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.182 0 C-N-CA 122.833 2.355 . . . . 0.0 110.835 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -177.67 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 112.13 -2.304 . . . . 0.0 107.94 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 152.94 -49.31 0.52 Allowed Glycine 0 N--CA 1.482 1.753 0 O-C-N 124.094 0.871 . . . . 0.0 111.933 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.67 161.14 14.16 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.469 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.6 165.17 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.557 1.161 . . . . 0.0 110.564 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.018 -1.99 . . . . 0.0 110.456 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.893 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -65.77 145.08 56.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 124.653 1.22 . . . . 0.0 110.697 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.5 p -124.67 119.46 29.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.067 0.854 . . . . 0.0 112.769 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.11 -20.72 26.67 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.068 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -136.25 161.86 34.6 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.301 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.23 -49.73 75.93 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -78.42 16.8 0.74 Allowed 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.163 -1.835 . . . . 0.0 113.272 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.7 -49.26 73.45 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.316 0.385 . . . . 0.0 110.794 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -81.62 -176.28 5.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.087 0.867 . . . . 0.0 110.303 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.96 151.58 21.6 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.56 111.0 0.57 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.557 -1.201 . . . . 0.0 110.724 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.13 -30.97 2.75 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -83.41 178.15 8.16 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 121.422 0.629 . . . . 0.0 110.885 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -151.43 166.08 2.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-N 114.091 -1.413 . . . . 0.0 107.332 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.36 105.14 17.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.67 0.606 . . . . 0.0 109.562 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.16 146.56 44.65 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -51.2 -24.73 15.75 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.305 2.003 . . . . 0.0 112.865 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.57 -19.23 14.82 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 111.77 -25.6 12.92 Favored Glycine 0 N--CA 1.482 1.745 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.05 164.98 11.34 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.196 -0.502 . . . . 0.0 109.661 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.8 m -63.01 158.62 18.97 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 CA-C-O 116.174 -2.459 . . . . 0.0 107.696 -179.828 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.9 mtt . . . . . 0 N--CA 1.496 1.864 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.0 mtm-85 -70.4 132.01 44.96 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.849 1.343 . . . . 0.0 109.986 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.73 177.67 4.78 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.874 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -136.55 -11.62 1.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.942 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -156.89 166.84 32.23 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -52.96 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -79.36 18.09 0.75 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.917 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -53.77 -38.84 64.86 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.485 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 m -79.48 -166.22 0.93 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.737 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -48.65 141.1 7.49 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.71 0.631 . . . . 0.0 112.543 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.5 107.84 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.001 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.47 -23.51 4.53 Favored Glycine 0 N--CA 1.497 2.758 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -79.6 160.03 26.57 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 122.063 0.935 . . . . 0.0 112.919 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.4 m -130.79 159.93 42.41 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 CA-C-N 112.751 -2.022 . . . . 0.0 106.089 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -119.7 87.9 2.83 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.09 176.43 3.65 Favored Glycine 0 N--CA 1.49 2.273 0 CA-C-N 115.685 -0.688 . . . . 0.0 113.322 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.54 86.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.884 2.389 . . . . 0.0 110.103 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 p30 179.65 -25.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 112.938 -1.937 . . . . 0.0 109.188 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.23 19.93 76.12 Favored Glycine 0 N--CA 1.487 2.069 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.832 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -124.85 147.55 48.7 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -61.65 136.4 57.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.153 -1.019 . . . . 0.0 108.679 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 116.115 -2.492 . . . . 0.0 108.335 -179.847 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 82.9 mtp . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -66.57 151.3 47.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.231 0.957 . . . . 0.0 110.401 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.4 t -100.08 172.03 7.45 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.015 0.912 . . . . 0.0 112.55 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -160.5 13.39 0.11 Allowed 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 113.077 -1.874 . . . . 0.0 108.252 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 140.07 169.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 126.867 2.067 . . . . 0.0 108.907 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.81 -55.46 26.37 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.552 0.691 . . . . 0.0 109.444 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.4 p -62.11 -14.2 34.36 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 113.817 -1.538 . . . . 0.0 114.43 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -50.82 -49.2 59.21 Favored 'General case' 0 N--CA 1.503 2.18 0 CA-C-O 121.886 0.85 . . . . 0.0 111.339 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -79.6 -170.85 2.53 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.858 -1.974 . . . . 0.0 109.538 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.65 141.07 53.69 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.32 103.54 0.05 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 123.836 0.71 . . . . 0.0 110.803 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.83 -31.64 1.61 Allowed Glycine 0 N--CA 1.496 2.652 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.1 m -79.97 -169.84 2.19 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.1 m -145.74 179.58 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -99.63 94.9 6.61 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.383 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.07 109.62 2.55 Favored Glycine 0 N--CA 1.489 2.169 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.089 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -50.3 -27.01 16.85 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.641 2.227 . . . . 0.0 113.908 -165.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -52.05 -32.75 35.89 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.863 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.82 -33.62 1.27 Allowed Glycine 0 N--CA 1.485 1.955 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -101.06 174.65 5.9 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.932 -0.634 . . . . 0.0 109.563 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 65.0 m -61.01 179.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.304 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.832 0 CA-C-O 116.451 -2.305 . . . . 0.0 113.659 -179.879 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 ptp . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.81 131.39 50.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.996 0.81 . . . . 0.0 111.902 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -93.16 -159.4 0.68 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.754 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 -18.37 0.09 Allowed 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 113.975 -1.466 . . . . 0.0 108.592 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -160.45 168.4 25.21 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 14' ' ' ASP . 36.1 t70 -58.07 -62.78 1.57 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.841 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.9 p -77.02 24.56 0.16 Allowed 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.413 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 12' ' ' ASP . 4.4 t70 -48.72 -52.83 21.51 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.78 -178.88 7.01 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-N 113.757 -1.565 . . . . 0.0 112.321 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -53.49 146.08 13.48 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.27 102.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.875 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 144.29 -34.0 1.66 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 108.731 -1.748 . . . . 0.0 108.731 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.5 m -86.31 163.14 17.87 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 114.948 -0.626 . . . . 0.0 109.328 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.1 155.11 6.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.705 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.8 t -98.02 128.08 44.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.65 1.219 . . . . 0.0 109.639 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -91.51 178.41 41.3 Favored Glycine 0 N--CA 1.479 1.547 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -53.26 -26.42 34.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.968 1.779 . . . . 0.0 110.734 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -59.88 -14.93 17.58 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.25 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.49 -13.0 54.03 Favored Glycine 0 N--CA 1.481 1.638 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -101.16 153.53 19.51 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.242 0.544 . . . . 0.0 111.584 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.41 178.31 2.98 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.549 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.801 0 CA-C-O 114.96 -3.133 . . . . 0.0 114.414 179.784 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.3 mmm . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.79 143.98 57.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 124.162 0.914 . . . . 0.0 108.877 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -118.07 -161.23 0.82 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.217 0.948 . . . . 0.0 111.581 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 -23.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.516 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -148.6 167.08 26.4 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.077 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.61 -54.07 45.05 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -74.73 8.42 2.42 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.771 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -48.76 -49.02 40.4 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 123.664 0.603 . . . . 0.0 111.584 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.5 m -84.54 -179.53 7.17 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.764 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.22 145.82 7.5 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.68 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.07 -30.21 2.85 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 109.349 -1.501 . . . . 0.0 109.349 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 80.3 m -79.89 152.87 29.38 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.155 0.502 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -136.19 150.0 27.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.504 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -119.61 120.73 37.53 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.378 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.29 178.82 53.79 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -49.93 -24.54 10.65 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 121.941 1.761 . . . . 0.0 111.795 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -57.93 -19.54 30.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.276 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.86 18.11 77.56 Favored Glycine 0 N--CA 1.486 1.973 0 O-C-N 123.492 0.495 . . . . 0.0 113.583 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -127.28 142.57 51.43 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 54.0 m -71.17 170.35 13.17 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 124.509 1.131 . . . . 0.0 110.892 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.72 0 CA-C-O 117.285 -1.842 . . . . 0.0 109.581 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.5 mmt . . . . . 0 N--CA 1.496 1.836 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.17 137.86 51.33 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 124.42 1.075 . . . . 0.0 109.376 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.9 p -137.63 -167.12 2.07 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.21 0.944 . . . . 0.0 111.6 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -159.91 -9.14 0.06 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -143.51 165.86 26.41 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.764 0.665 . . . . 0.0 109.894 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -54.97 -70.01 0.12 Allowed 'General case' 0 N--CA 1.49 1.575 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.908 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.1 p -74.76 11.67 1.0 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.957 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -52.73 -43.43 65.71 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 123.578 0.549 . . . . 0.0 110.696 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.6 m -92.48 -163.11 1.0 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.995 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.68 138.83 58.62 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.514 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.46 105.1 0.08 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 124.255 0.972 . . . . 0.0 111.548 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 143.65 -34.35 1.7 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.28 -1.528 . . . . 0.0 109.28 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -86.71 164.24 16.87 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 124.012 0.477 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.3 m -146.88 147.0 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 O-C-N 124.302 1.001 . . . . 0.0 109.638 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.14 141.36 35.98 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.003 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -140.8 -161.93 8.9 Favored Glycine 0 N--CA 1.483 1.776 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -53.56 -25.89 34.66 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.089 1.859 . . . . 0.0 112.74 -174.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -61.4 -19.38 61.84 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.15 -13.41 20.37 Favored Glycine 0 N--CA 1.482 1.711 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -105.86 155.41 19.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.963 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 58.5 m -60.76 166.94 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.415 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 CA-C-O 116.459 -2.301 . . . . 0.0 109.567 -179.767 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 77.4 mtp . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.17 147.87 42.21 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.02 0.825 . . . . 0.0 109.354 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.56 163.24 30.17 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.964 0.887 . . . . 0.0 112.517 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.11 -15.5 8.71 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.611 -2.086 . . . . 0.0 108.653 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -139.98 153.33 46.85 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-O 121.234 0.54 . . . . 0.0 111.066 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.17 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.137 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.2 p -71.56 9.62 0.8 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -51.38 -38.1 51.63 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 123.674 0.609 . . . . 0.0 112.141 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.5 m -79.06 -163.53 0.5 Allowed 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.174 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.95 141.23 18.26 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 123.843 0.715 . . . . 0.0 110.735 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.96 102.55 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.669 0.605 . . . . 0.0 112.309 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.61 -21.95 3.96 Favored Glycine 0 N--CA 1.498 2.794 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.811 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 5.6 m -79.28 172.95 13.09 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.26 1.028 . . . . 0.0 112.385 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.75 178.54 4.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-N 112.574 -2.103 . . . . 0.0 106.96 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.23 135.45 54.98 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.53 159.26 36.54 Favored Glycine 0 N--CA 1.481 1.634 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.229 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -51.9 -28.05 30.01 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 C-N-CA 122.09 1.86 . . . . 0.0 111.719 177.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 p30 -63.7 -9.15 12.65 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.96 -2.67 79.94 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 114.956 0.742 . . . . 0.0 114.956 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -113.36 162.69 15.77 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.29 0.567 . . . . 0.0 110.75 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.9 m -57.53 165.23 1.64 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.633 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 CA-C-O 116.516 -2.269 . . . . 0.0 110.552 179.947 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 32.5 mtp . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.74 139.02 36.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.587 1.179 . . . . 0.0 109.114 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.443 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 1.8 p -129.83 -173.85 3.15 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.379 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -139.72 -37.42 0.49 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.748 -1.114 . . . . 0.0 108.732 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -122.38 168.36 12.17 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.909 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.43 -67.66 0.31 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 p -61.95 -1.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 114.437 -1.256 . . . . 0.0 113.801 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.43 -41.41 66.04 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.7 m -92.76 -164.06 1.13 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 113.92 -1.491 . . . . 0.0 109.079 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.7 tt -57.83 133.78 55.71 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.174 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.91 110.04 0.23 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.746 0.654 . . . . 0.0 112.508 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.29 -27.35 4.79 Favored Glycine 0 N--CA 1.495 2.593 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.522 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 m -78.83 149.77 32.45 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.431 0.634 . . . . 0.0 111.66 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 m -111.35 153.69 13.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 CA-C-N 113.517 -1.674 . . . . 0.0 108.402 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 t -112.57 90.87 3.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 124.475 1.109 . . . . 0.0 109.523 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.59 170.56 27.28 Favored Glycine 0 N--CA 1.488 2.155 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.612 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -51.4 -26.62 21.74 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 C-N-CA 122.265 1.977 . . . . 0.0 113.132 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -57.03 -21.7 33.12 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.71 -19.8 48.93 Favored Glycine 0 N--CA 1.477 1.412 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -98.56 144.43 27.88 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 123.663 0.272 . . . . 0.0 110.282 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.3 144.89 55.64 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.946 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.919 0 CA-C-O 115.702 -2.721 . . . . 0.0 113.368 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 40.7 ttm . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.69 139.87 58.42 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.5 p -100.95 128.96 46.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 ptmt -93.75 -20.19 20.35 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.95 157.75 42.2 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 114.476 -1.238 . . . . 0.0 107.795 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -54.19 -68.53 0.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.021 0.438 . . . . 0.0 111.13 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.4 p -73.33 17.67 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.756 -1.111 . . . . 0.0 113.733 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -53.3 -46.78 69.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.488 0.492 . . . . 0.0 111.688 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -79.31 -177.16 5.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.679 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.05 152.28 0.56 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.94 108.07 0.32 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.871 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.88 -22.86 4.01 Favored Glycine 0 N--CA 1.495 2.6 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.558 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.4 m -79.53 152.14 30.33 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.155 0.979 . . . . 0.0 112.767 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.4 m -144.02 151.39 16.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-N 112.539 -2.119 . . . . 0.0 105.905 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.9 t -101.66 100.56 10.96 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.306 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.31 -175.43 21.88 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -54.09 -13.97 5.51 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 122.093 1.862 . . . . 0.0 113.054 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.72 -20.5 66.37 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.68 -15.81 39.7 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.63 169.07 8.67 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.1 m -62.2 165.84 5.43 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.6 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.245 -179.675 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.3 ttp . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 142.43 58.4 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.357 1.036 . . . . 0.0 110.335 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.41 ' SG ' ' C ' ' A' ' 26' ' ' PHE . 31.3 p -155.89 175.06 14.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.796 0.685 . . . . 0.0 111.522 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -146.76 -11.04 0.45 Allowed 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -141.07 160.89 39.12 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 123.777 0.673 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.17 -64.3 0.88 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.8 p -61.79 -10.41 8.93 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.153 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.64 -46.26 58.27 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.68 0.613 . . . . 0.0 110.812 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.4 m -91.38 -166.11 1.5 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.156 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.53 141.19 32.16 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 123.715 0.634 . . . . 0.0 112.268 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 107.18 0.2 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.967 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.45 -20.58 5.82 Favored Glycine 0 N--CA 1.499 2.872 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.631 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.2 m -79.65 167.99 19.95 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.443 0.64 . . . . 0.0 112.398 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.6 m -130.16 157.92 42.65 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.75 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.1 t -114.0 87.84 2.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.987 0.804 . . . . 0.0 108.938 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.8 173.6 4.64 Favored Glycine 0 N--CA 1.49 2.299 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.414 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -53.72 -23.78 27.67 Favored 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 122.468 2.112 . . . . 0.0 113.19 -175.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -60.15 -14.28 16.39 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.73 9.44 87.06 Favored Glycine 0 N--CA 1.483 1.775 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.41 ' C ' ' SG ' ' A' ' 9' ' ' CYS . 7.4 m-85 -126.99 155.48 43.13 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.9 m -60.1 147.58 38.96 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.653 0.739 . . . . 0.0 110.639 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.416 0 CA-C-O 117.038 -1.979 . . . . 0.0 109.204 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.4 mtt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 120.29 0.09 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -106.21 127.76 53.46 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.521 ' SG ' ' N ' ' A' ' 10' ' ' LYS . 0.5 OUTLIER -120.97 -161.02 0.87 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 123.956 0.785 . . . . 0.0 111.239 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.521 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 1.6 tptm -152.84 -26.32 0.15 Allowed 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.984 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -150.69 171.62 16.87 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -50.12 -75.16 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -78.68 18.14 0.62 Allowed 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.718 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.48 -36.2 68.83 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.618 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.4 m -79.15 -168.75 1.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.819 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.81 146.84 35.67 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.259 0.836 . . . . 0.0 113.259 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.57 104.34 0.06 Allowed 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.401 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.34 -30.7 2.5 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 2.8 m -82.87 157.48 23.08 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 122.184 0.993 . . . . 0.0 112.466 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.0 m -133.65 160.14 42.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 104.171 -2.529 . . . . 0.0 104.171 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.0 t -121.5 140.61 51.97 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.941 -0.704 . . . . 0.0 112.764 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.92 174.32 47.71 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 113.934 -1.485 . . . . 0.0 110.141 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -52.92 -30.42 48.08 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.091 1.861 . . . . 0.0 110.651 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -61.35 -9.55 5.53 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 113.662 -1.608 . . . . 0.0 114.196 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.18 17.79 76.1 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 111.9 -0.48 . . . . 0.0 111.9 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -117.19 144.0 45.24 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.967 -0.617 . . . . 0.0 109.794 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.0 m -74.12 146.74 43.31 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 124.311 1.007 . . . . 0.0 112.628 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 115.937 -2.59 . . . . 0.0 109.702 179.714 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.3 ptm . . . . . 0 N--CA 1.499 1.993 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.59 142.88 42.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.003 0.815 . . . . 0.0 108.964 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.473 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . 2.1 p -123.79 128.59 49.76 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 124.252 0.97 . . . . 0.0 112.128 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -82.71 -32.32 28.07 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.862 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -138.44 170.57 15.79 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.316 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -57.74 -60.48 3.63 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.023 0.44 . . . . 0.0 111.388 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.2 p -68.36 6.97 0.67 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.63 -45.85 63.43 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 123.47 0.481 . . . . 0.0 111.385 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -81.68 -177.14 6.42 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.487 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.92 147.46 12.19 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.044 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.34 106.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.647 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.85 -26.6 2.87 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.8 m -84.92 172.44 11.37 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.118 0.961 . . . . 0.0 111.973 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 m -141.67 165.92 17.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.887 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 t -92.98 108.91 20.37 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.207 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.16 115.86 6.18 Favored Glycine 0 N--CA 1.49 2.239 0 CA-C-O 118.23 -1.317 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.33 85.78 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 123.038 2.492 . . . . 0.0 112.19 -173.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.3 p30 177.98 -35.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.11 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.84 -42.71 0.62 Allowed Glycine 0 N--CA 1.482 1.75 0 O-C-N 123.986 0.804 . . . . 0.0 112.982 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -92.97 149.98 20.86 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 2.3 m -63.82 172.42 2.24 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 124.844 1.34 . . . . 0.0 113.019 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.469 0 CA-C-O 115.881 -2.621 . . . . 0.0 110.829 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 57.1 mtp . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.35 133.91 51.48 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 123.817 0.698 . . . . 0.0 112.604 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.58 177.9 4.65 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.967 -1.47 . . . . 0.0 109.645 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -149.8 -26.78 0.26 Allowed 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.098 -1.41 . . . . 0.0 108.205 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -155.17 167.29 30.84 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.01 -67.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.019 0.438 . . . . 0.0 110.001 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.0 p -67.36 -3.16 7.42 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.808 -1.087 . . . . 0.0 113.286 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -52.21 -38.63 58.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 123.515 0.509 . . . . 0.0 112.128 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.6 m -97.27 -164.63 1.17 Allowed 'General case' 0 N--CA 1.484 1.272 0 O-C-N 124.651 1.219 . . . . 0.0 111.091 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.3 142.16 10.55 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 124.02 0.825 . . . . 0.0 111.684 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.1 113.03 0.98 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.871 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.28 -21.64 9.24 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.163 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -79.92 162.95 24.68 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 120.563 0.22 . . . . 0.0 110.971 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.8 m -134.76 154.78 37.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 O-C-N 124.312 1.008 . . . . 0.0 110.066 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.5 t -90.35 107.11 18.94 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.747 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.31 170.22 54.49 Favored Glycine 0 N--CA 1.484 1.86 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.927 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.98 -36.26 99.18 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.416 2.078 . . . . 0.0 111.22 177.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -65.99 -1.55 3.17 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.843 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.44 13.85 82.51 Favored Glycine 0 N--CA 1.482 1.711 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.951 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -110.35 149.24 30.5 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.178 0.513 . . . . 0.0 111.605 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.0 m -62.54 165.96 5.74 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.153 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.84 0 CA-C-O 117.669 -1.629 . . . . 0.0 112.868 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.978 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.01 147.46 32.87 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.176 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.2 p -138.0 141.6 40.44 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.8 18.02 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.126 -1.397 . . . . 0.0 109.186 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -139.52 174.51 10.44 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.754 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.68 -53.11 61.35 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.282 0.563 . . . . 0.0 109.749 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 p -57.49 -11.83 2.24 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.182 -1.372 . . . . 0.0 114.184 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -49.0 -47.14 44.59 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 123.894 0.746 . . . . 0.0 112.223 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.5 m -90.82 177.91 6.19 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.487 1.117 . . . . 0.0 110.338 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.5 155.44 40.58 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.921 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.63 112.31 0.58 Allowed 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 134.7 -34.59 2.32 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -90.6 155.49 18.82 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.719 0.771 . . . . 0.0 111.235 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.1 m -128.96 167.65 23.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 CA-C-N 113.222 -1.808 . . . . 0.0 107.506 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 t -111.19 111.68 22.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 123.674 0.609 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.73 147.81 26.91 Favored Glycine 0 CA--C 1.541 1.705 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -52.45 -21.49 14.06 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.315 2.01 . . . . 0.0 113.145 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -56.43 -27.08 55.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 124.132 0.895 . . . . 0.0 113.26 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 122.54 -38.96 2.4 Favored Glycine 0 N--CA 1.481 1.676 0 O-C-N 123.947 0.779 . . . . 0.0 111.205 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -93.59 158.08 15.87 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 115.233 -0.484 . . . . 0.0 111.301 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.89 178.28 2.25 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.747 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 179.833 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 110.048 -1.221 . . . . 0.0 110.048 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 t -126.63 104.15 24.36 Favored Pre-proline 0 N--CA 1.496 1.867 0 CA-C-N 114.924 -0.638 . . . . 0.0 109.919 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -67.01 -168.3 0.16 Allowed 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.864 1.709 . . . . 0.0 111.88 173.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -159.49 137.25 10.08 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.756 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 178.62 171.06 0.81 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.46 -1.246 . . . . 0.0 108.517 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.34 83.16 0.15 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.865 0.84 . . . . 0.0 110.291 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 24.3 mmm -124.96 103.97 8.32 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.81 138.05 58.15 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 124.579 1.174 . . . . 0.0 111.837 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -126.46 163.8 22.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 124.319 1.012 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -138.69 -20.97 1.01 Allowed 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.288 -1.778 . . . . 0.0 108.393 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -145.34 163.25 35.13 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.388 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -57.31 -57.65 11.69 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.527 0.68 . . . . 0.0 109.948 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.3 p -54.63 -13.12 0.89 Allowed 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 113.879 -1.51 . . . . 0.0 114.458 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -47.12 -45.72 22.49 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.029 0.831 . . . . 0.0 112.113 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.2 m -89.57 -169.69 2.57 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.991 -1.913 . . . . 0.0 111.471 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mt -75.78 144.97 41.09 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.549 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.03 106.92 0.1 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 124.238 0.962 . . . . 0.0 111.24 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.77 -35.33 1.79 Allowed Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -89.02 172.13 9.34 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.742 0.782 . . . . 0.0 111.301 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.2 m -135.6 167.23 25.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 CA-C-N 113.293 -1.776 . . . . 0.0 107.028 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 t -74.96 98.11 3.51 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.238 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.412 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -49.2 112.06 1.19 Allowed Glycine 0 N--CA 1.494 2.5 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.39 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo -62.19 85.99 0.1 Allowed 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 123.321 2.681 . . . . 0.0 110.675 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -179.76 -35.58 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.198 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.08 -53.46 0.4 Allowed Glycine 0 N--CA 1.48 1.619 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -96.96 162.21 13.49 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.114 -0.543 . . . . 0.0 111.026 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.412 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 63.8 m -51.25 159.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 125.002 1.439 . . . . 0.0 113.205 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.642 0 CA-C-O 117.297 -1.835 . . . . 0.0 111.048 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.8 t -74.23 144.77 82.13 Favored Pre-proline 0 N--CA 1.494 1.769 0 CA-C-O 119.003 -0.523 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -59.75 -165.84 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.382 2.055 . . . . 0.0 113.228 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.2 mtt-85 -43.12 125.23 3.56 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.859 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.7 132.79 26.23 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.649 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 6.5 mp 52.99 79.21 0.12 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 124.84 1.338 . . . . 0.0 112.534 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.5 141.88 36.23 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.28 129.09 40.39 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.759 0.662 . . . . 0.0 109.796 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER -138.73 133.63 32.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.003 0.814 . . . . 0.0 111.73 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -85.53 -28.03 25.2 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.212 -1.358 . . . . 0.0 109.712 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -132.78 165.73 23.88 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.314 1.009 . . . . 0.0 110.115 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.4 -56.65 17.91 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.0 p -65.64 1.69 1.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.972 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.86 -46.23 51.28 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.659 0.6 . . . . 0.0 111.703 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.1 m -85.04 -178.21 6.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.026 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 143.76 43.62 Favored 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.832 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.68 103.56 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.154 0.909 . . . . 0.0 111.318 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 142.62 -32.39 1.95 Allowed Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -79.85 166.46 21.67 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.965 0.412 . . . . 0.0 109.974 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.3 m -146.39 147.33 18.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.851 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -104.91 118.26 36.09 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 113.44 -1.709 . . . . 0.0 108.736 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.74 178.42 53.3 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -51.57 -24.06 16.25 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.869 1.712 . . . . 0.0 111.372 170.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -60.68 -18.91 56.81 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.323 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.66 5.1 89.76 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -122.35 143.89 49.36 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.336 0.589 . . . . 0.0 110.134 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 73.2 m -64.4 172.5 2.53 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.159 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.677 0 CA-C-O 116.527 -2.263 . . . . 0.0 110.2 179.768 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.519 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 8.5 t -58.04 -40.99 87.44 Favored Pre-proline 0 N--CA 1.495 1.792 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' A' ' 2' ' ' CYS . 3.0 Cg_endo -70.83 129.99 17.33 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.447 2.098 . . . . 0.0 109.691 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.71 -172.1 2.04 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.263 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.19 -179.26 0.14 Allowed 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.738 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -48.83 82.27 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 124.472 1.107 . . . . 0.0 113.559 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 46.2 ttm -98.16 107.83 20.39 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.215 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.32 150.37 33.29 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.367 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.0 155.22 19.6 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.774 0.797 . . . . 0.0 111.183 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -124.12 -19.56 5.56 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.078 -1.874 . . . . 0.0 107.413 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -150.86 154.27 36.9 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -53.81 -44.3 70.08 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.141 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.8 p -79.2 22.46 0.41 Allowed 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.443 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -52.68 -36.37 56.93 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -93.34 -173.78 3.33 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.204 0.94 . . . . 0.0 110.821 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.3 147.43 25.62 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.712 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.21 108.02 0.17 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.695 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.57 -32.78 2.35 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.2 m -81.11 165.18 21.84 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.012 -0.594 . . . . 0.0 110.057 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.55 154.39 12.39 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.269 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -84.34 140.56 31.51 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.89 168.21 24.63 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -52.77 -28.7 39.3 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 122.1 1.867 . . . . 0.0 111.743 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p30 -60.4 -15.72 28.9 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.815 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.58 0.09 79.61 Favored Glycine 0 N--CA 1.481 1.654 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -110.02 163.44 13.57 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -58.41 173.59 0.37 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.874 0.845 . . . . 0.0 111.87 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.45 0 CA-C-O 116.156 -2.469 . . . . 0.0 109.559 179.961 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 52.0 t -126.59 83.1 65.57 Favored Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -62.01 104.7 0.35 Allowed 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 122.147 1.898 . . . . 0.0 110.685 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -169.21 153.71 5.56 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.461 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 mp -57.21 153.16 12.41 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.419 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp -56.34 100.0 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 124.245 0.965 . . . . 0.0 111.204 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.6 ttt -126.04 130.79 51.84 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -72.14 145.44 48.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.473 1.108 . . . . 0.0 110.824 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.73 166.89 10.35 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.558 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -118.6 -26.48 6.15 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 113.403 -1.726 . . . . 0.0 107.21 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -152.34 172.62 16.18 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.827 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.2 -56.91 16.12 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.343 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.7 p -71.77 3.04 4.5 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -48.18 -46.18 34.55 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -78.51 -171.72 2.59 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.6 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 mt -47.9 141.29 5.9 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.92 107.04 0.22 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.614 0.571 . . . . 0.0 110.958 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.58 -21.92 4.19 Favored Glycine 0 N--CA 1.498 2.769 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.236 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.2 m -78.95 173.93 12.05 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.147 0.975 . . . . 0.0 111.532 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.6 m -143.04 170.04 11.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-N 112.765 -2.016 . . . . 0.0 106.564 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 t -114.95 140.38 49.05 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -97.37 160.18 21.26 Favored Glycine 0 CA--C 1.538 1.478 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -52.01 -22.41 14.46 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.919 1.746 . . . . 0.0 112.409 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -14.82 22.65 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.43 -21.46 46.0 Favored Glycine 0 N--CA 1.48 1.584 0 O-C-N 123.687 0.617 . . . . 0.0 112.117 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -102.04 168.62 9.27 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 120.776 0.322 . . . . 0.0 110.783 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 72.1 m -50.55 164.61 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 124.547 1.154 . . . . 0.0 111.207 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 -179.538 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.7 t -120.67 100.98 46.31 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 124.215 0.597 . . . . 0.0 110.327 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -67.44 169.16 16.17 Favored 'Trans proline' 0 N--CA 1.487 1.112 0 C-N-CA 121.97 1.78 . . . . 0.0 110.913 165.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.6 73.51 2.6 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.803 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.4 145.94 52.67 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.331 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 79.51 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 O-C-N 124.424 1.077 . . . . 0.0 111.594 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.49 129.04 12.23 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.206 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.19 146.24 39.27 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 124.758 1.286 . . . . 0.0 110.754 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.2 p -139.42 -172.8 3.44 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.097 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -158.74 -13.79 0.07 Allowed 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.592 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -131.5 159.72 37.3 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.84 -65.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 82.5 p -72.05 9.13 1.02 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.135 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -50.2 -48.92 54.04 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 123.674 0.609 . . . . 0.0 111.28 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -86.21 -166.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 114.053 -1.431 . . . . 0.0 111.669 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 mp -50.78 134.95 24.6 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.047 0.842 . . . . 0.0 111.91 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.81 109.04 0.21 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 123.659 0.6 . . . . 0.0 112.086 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 131.54 -30.08 3.33 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 25.5 m -81.53 161.51 23.56 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.471 0.653 . . . . 0.0 110.595 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.3 m -132.92 161.88 40.9 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 CA-C-N 113.91 -1.496 . . . . 0.0 108.004 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 t -105.59 119.34 38.87 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.92 172.98 48.53 Favored Glycine 0 N--CA 1.481 1.674 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.76 -20.18 42.02 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.748 1.632 . . . . 0.0 111.099 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.543 HD21 ' H ' ' A' ' 26' ' ' PHE . 7.8 p-10 -66.09 -10.29 39.11 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.183 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.18 -7.53 67.05 Favored Glycine 0 N--CA 1.483 1.781 0 CA-C-O 119.903 -0.387 . . . . 0.0 114.006 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.543 ' H ' HD21 ' A' ' 24' ' ' ASN . 5.5 m-85 -115.1 161.11 18.83 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.466 0.65 . . . . 0.0 110.687 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -68.24 143.31 55.33 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.473 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 115.9 -2.611 . . . . 0.0 107.594 179.628 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.329 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.7 t -71.81 124.74 91.34 Favored Pre-proline 0 N--CA 1.497 1.909 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.307 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -66.98 -166.43 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 122.507 2.138 . . . . 0.0 111.959 173.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -163.91 81.35 0.43 Allowed 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 114.667 -1.151 . . . . 0.0 107.96 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -128.11 135.56 49.96 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 113.571 -1.65 . . . . 0.0 107.868 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.83 93.8 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 O-C-N 124.204 0.94 . . . . 0.0 111.062 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 42.1 mtt -137.9 132.19 32.08 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.593 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -72.63 146.98 46.23 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.122 0.889 . . . . 0.0 111.255 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.8 p -141.68 162.13 36.24 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.108 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -131.19 -6.55 3.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 113.65 -1.614 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -133.96 153.28 51.88 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.982 0.801 . . . . 0.0 110.876 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.19 -61.1 2.8 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.4 p -69.09 4.46 1.58 Allowed 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.992 -1.458 . . . . 0.0 112.849 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -53.36 -45.44 69.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.519 0.512 . . . . 0.0 110.636 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.2 -174.67 5.18 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 124.188 0.93 . . . . 0.0 110.059 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.31 162.82 21.96 Favored 'General case' 0 N--CA 1.499 2.02 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.95 124.37 8.59 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.118 -1.401 . . . . 0.0 112.262 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.34 -24.8 21.72 Favored Glycine 0 N--CA 1.495 2.621 0 O-C-N 124.574 1.171 . . . . 0.0 112.226 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.3 m -86.37 170.43 12.02 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.718 0.77 . . . . 0.0 112.075 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -146.47 161.13 10.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.493 -1.685 . . . . 0.0 106.52 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.94 101.27 8.52 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.838 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -53.29 115.23 4.46 Favored Glycine 0 N--CA 1.491 2.314 0 CA-C-O 118.374 -1.237 . . . . 0.0 111.318 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -59.53 87.88 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.182 0 C-N-CA 122.833 2.355 . . . . 0.0 110.835 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -177.67 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 112.13 -2.304 . . . . 0.0 107.94 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 152.94 -49.31 0.52 Allowed Glycine 0 N--CA 1.482 1.753 0 O-C-N 124.094 0.871 . . . . 0.0 111.933 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.67 161.14 14.16 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.469 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.6 165.17 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.557 1.161 . . . . 0.0 110.564 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.018 -1.99 . . . . 0.0 110.456 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.431 ' SG ' HD23 ' A' ' 5' ' ' LEU . 42.2 t -71.94 130.55 86.58 Favored Pre-proline 0 N--CA 1.495 1.816 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.158 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.27 -179.56 0.64 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.277 1.984 . . . . 0.0 112.947 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 119.75 3.57 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.431 HD23 ' SG ' ' A' ' 2' ' ' CYS . 25.0 mt -89.25 111.67 22.54 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.12 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -179.62 41.03 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 124.089 0.868 . . . . 0.0 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.66 143.52 33.65 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.703 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -65.77 145.08 56.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 124.653 1.22 . . . . 0.0 110.697 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.5 p -124.67 119.46 29.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.067 0.854 . . . . 0.0 112.769 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.11 -20.72 26.67 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.068 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -136.25 161.86 34.6 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.301 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.23 -49.73 75.93 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -78.42 16.8 0.74 Allowed 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.163 -1.835 . . . . 0.0 113.272 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.7 -49.26 73.45 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.316 0.385 . . . . 0.0 110.794 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -81.62 -176.28 5.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.087 0.867 . . . . 0.0 110.303 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.96 151.58 21.6 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.56 111.0 0.57 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.557 -1.201 . . . . 0.0 110.724 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.13 -30.97 2.75 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -83.41 178.15 8.16 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 121.422 0.629 . . . . 0.0 110.885 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -151.43 166.08 2.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-N 114.091 -1.413 . . . . 0.0 107.332 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.36 105.14 17.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.67 0.606 . . . . 0.0 109.562 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.16 146.56 44.65 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -51.2 -24.73 15.75 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.305 2.003 . . . . 0.0 112.865 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.57 -19.23 14.82 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 111.77 -25.6 12.92 Favored Glycine 0 N--CA 1.482 1.745 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.05 164.98 11.34 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.196 -0.502 . . . . 0.0 109.661 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.8 m -63.01 158.62 18.97 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 CA-C-O 116.174 -2.459 . . . . 0.0 107.696 -179.828 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.42 133.51 95.39 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.953 -0.546 . . . . 0.0 110.808 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -63.13 151.21 85.94 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.135 1.89 . . . . 0.0 111.979 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 139.3 50.79 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.766 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -170.47 112.47 0.42 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 124.108 0.88 . . . . 0.0 109.936 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.61 91.49 0.8 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.82 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.9 mtt -142.41 129.18 20.49 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.601 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.0 mtm-85 -70.4 132.01 44.96 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.849 1.343 . . . . 0.0 109.986 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.73 177.67 4.78 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.874 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -136.55 -11.62 1.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.942 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -156.89 166.84 32.23 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -52.96 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -79.36 18.09 0.75 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.917 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -53.77 -38.84 64.86 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.485 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 m -79.48 -166.22 0.93 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.737 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -48.65 141.1 7.49 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.71 0.631 . . . . 0.0 112.543 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.5 107.84 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.001 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.47 -23.51 4.53 Favored Glycine 0 N--CA 1.497 2.758 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -79.6 160.03 26.57 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 122.063 0.935 . . . . 0.0 112.919 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.4 m -130.79 159.93 42.41 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 CA-C-N 112.751 -2.022 . . . . 0.0 106.089 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -119.7 87.9 2.83 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.09 176.43 3.65 Favored Glycine 0 N--CA 1.49 2.273 0 CA-C-N 115.685 -0.688 . . . . 0.0 113.322 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.54 86.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.884 2.389 . . . . 0.0 110.103 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 p30 179.65 -25.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 112.938 -1.937 . . . . 0.0 109.188 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.23 19.93 76.12 Favored Glycine 0 N--CA 1.487 2.069 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.832 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -124.85 147.55 48.7 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -61.65 136.4 57.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.153 -1.019 . . . . 0.0 108.679 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 116.115 -2.492 . . . . 0.0 108.335 -179.847 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.82 132.13 58.4 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.778 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -65.72 -169.68 0.16 Allowed 'Trans proline' 0 N--CA 1.492 1.428 0 C-N-CA 122.219 1.946 . . . . 0.0 111.403 170.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -59.39 137.22 58.07 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -93.57 160.14 14.92 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.049 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -175.82 37.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.75 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 82.9 mtp -142.35 149.92 40.06 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.179 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -66.57 151.3 47.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.231 0.957 . . . . 0.0 110.401 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.4 t -100.08 172.03 7.45 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.015 0.912 . . . . 0.0 112.55 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -160.5 13.39 0.11 Allowed 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 113.077 -1.874 . . . . 0.0 108.252 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 140.07 169.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 126.867 2.067 . . . . 0.0 108.907 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.81 -55.46 26.37 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.552 0.691 . . . . 0.0 109.444 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.4 p -62.11 -14.2 34.36 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 113.817 -1.538 . . . . 0.0 114.43 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -50.82 -49.2 59.21 Favored 'General case' 0 N--CA 1.503 2.18 0 CA-C-O 121.886 0.85 . . . . 0.0 111.339 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -79.6 -170.85 2.53 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.858 -1.974 . . . . 0.0 109.538 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.65 141.07 53.69 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.32 103.54 0.05 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 123.836 0.71 . . . . 0.0 110.803 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.83 -31.64 1.61 Allowed Glycine 0 N--CA 1.496 2.652 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.1 m -79.97 -169.84 2.19 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.1 m -145.74 179.58 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -99.63 94.9 6.61 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.383 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.07 109.62 2.55 Favored Glycine 0 N--CA 1.489 2.169 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.089 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -50.3 -27.01 16.85 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.641 2.227 . . . . 0.0 113.908 -165.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -52.05 -32.75 35.89 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.863 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.82 -33.62 1.27 Allowed Glycine 0 N--CA 1.485 1.955 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -101.06 174.65 5.9 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.932 -0.634 . . . . 0.0 109.563 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 65.0 m -61.01 179.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.304 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.832 0 CA-C-O 116.451 -2.305 . . . . 0.0 113.659 -179.879 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.423 ' SG ' ' HB3' ' A' ' 15' ' ' CYS . 9.1 t -145.93 75.57 12.96 Favored Pre-proline 0 N--CA 1.495 1.797 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -67.36 137.69 44.12 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 121.893 1.728 . . . . 0.0 109.862 174.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.35 114.8 0.67 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.52 1.138 . . . . 0.0 112.395 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tp -171.22 159.64 5.93 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.46 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -84.06 47.93 1.39 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 ptp -77.09 130.02 36.83 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.81 131.39 50.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.996 0.81 . . . . 0.0 111.902 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -93.16 -159.4 0.68 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.754 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 -18.37 0.09 Allowed 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 113.975 -1.466 . . . . 0.0 108.592 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -160.45 168.4 25.21 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 14' ' ' ASP . 36.1 t70 -58.07 -62.78 1.57 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.841 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.9 p -77.02 24.56 0.16 Allowed 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.413 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 12' ' ' ASP . 4.4 t70 -48.72 -52.83 21.51 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 2' ' ' CYS . 89.4 m -80.78 -178.88 7.01 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-N 113.757 -1.565 . . . . 0.0 112.321 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -53.49 146.08 13.48 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.27 102.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.875 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 144.29 -34.0 1.66 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 108.731 -1.748 . . . . 0.0 108.731 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.5 m -86.31 163.14 17.87 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 114.948 -0.626 . . . . 0.0 109.328 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.1 155.11 6.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.705 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.8 t -98.02 128.08 44.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.65 1.219 . . . . 0.0 109.639 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -91.51 178.41 41.3 Favored Glycine 0 N--CA 1.479 1.547 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -53.26 -26.42 34.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.968 1.779 . . . . 0.0 110.734 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -59.88 -14.93 17.58 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.25 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.49 -13.0 54.03 Favored Glycine 0 N--CA 1.481 1.638 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -101.16 153.53 19.51 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.242 0.544 . . . . 0.0 111.584 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.41 178.31 2.98 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.549 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.801 0 CA-C-O 114.96 -3.133 . . . . 0.0 114.414 179.784 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 t -119.37 93.31 47.05 Favored Pre-proline 0 N--CA 1.496 1.854 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.42 119.7 6.91 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 C-N-CA 121.581 1.521 . . . . 0.0 110.9 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -51.85 142.95 14.2 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.672 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.39 133.36 1.71 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 tt -58.35 96.59 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 124.252 0.97 . . . . 0.0 109.812 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.3 mmm -140.59 115.91 9.98 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.294 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.79 143.98 57.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 124.162 0.914 . . . . 0.0 108.877 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -118.07 -161.23 0.82 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.217 0.948 . . . . 0.0 111.581 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 -23.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.516 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -148.6 167.08 26.4 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.077 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.61 -54.07 45.05 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -74.73 8.42 2.42 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.771 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -48.76 -49.02 40.4 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 123.664 0.603 . . . . 0.0 111.584 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.5 m -84.54 -179.53 7.17 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.764 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.22 145.82 7.5 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.68 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.07 -30.21 2.85 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 109.349 -1.501 . . . . 0.0 109.349 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 80.3 m -79.89 152.87 29.38 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.155 0.502 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -136.19 150.0 27.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.504 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -119.61 120.73 37.53 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.378 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.29 178.82 53.79 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -49.93 -24.54 10.65 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 121.941 1.761 . . . . 0.0 111.795 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -57.93 -19.54 30.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.276 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.86 18.11 77.56 Favored Glycine 0 N--CA 1.486 1.973 0 O-C-N 123.492 0.495 . . . . 0.0 113.583 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -127.28 142.57 51.43 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 54.0 m -71.17 170.35 13.17 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 124.509 1.131 . . . . 0.0 110.892 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.72 0 CA-C-O 117.285 -1.842 . . . . 0.0 109.581 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.14 126.66 91.76 Favored Pre-proline 0 N--CA 1.497 1.905 0 CA-C-N 114.844 -0.678 . . . . 0.0 110.635 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -64.28 121.43 9.06 Favored 'Trans proline' 0 N--CA 1.488 1.17 0 C-N-CA 121.849 1.7 . . . . 0.0 110.395 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -57.78 109.4 0.71 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 124.219 0.95 . . . . 0.0 110.562 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.7 124.91 0.47 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.044 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.15 71.49 5.65 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 122.061 0.934 . . . . 0.0 111.483 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.5 mmt -90.72 137.13 32.6 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.328 -1.306 . . . . 0.0 108.232 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.17 137.86 51.33 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 124.42 1.075 . . . . 0.0 109.376 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.9 p -137.63 -167.12 2.07 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.21 0.944 . . . . 0.0 111.6 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -159.91 -9.14 0.06 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -143.51 165.86 26.41 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.764 0.665 . . . . 0.0 109.894 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -54.97 -70.01 0.12 Allowed 'General case' 0 N--CA 1.49 1.575 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.908 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.1 p -74.76 11.67 1.0 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.957 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -52.73 -43.43 65.71 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 123.578 0.549 . . . . 0.0 110.696 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.6 m -92.48 -163.11 1.0 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.995 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.68 138.83 58.62 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.514 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.46 105.1 0.08 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 124.255 0.972 . . . . 0.0 111.548 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 143.65 -34.35 1.7 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.28 -1.528 . . . . 0.0 109.28 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -86.71 164.24 16.87 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 124.012 0.477 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.3 m -146.88 147.0 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 O-C-N 124.302 1.001 . . . . 0.0 109.638 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.14 141.36 35.98 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.003 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -140.8 -161.93 8.9 Favored Glycine 0 N--CA 1.483 1.776 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -53.56 -25.89 34.66 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.089 1.859 . . . . 0.0 112.74 -174.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -61.4 -19.38 61.84 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.15 -13.41 20.37 Favored Glycine 0 N--CA 1.482 1.711 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -105.86 155.41 19.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.963 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 58.5 m -60.76 166.94 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.415 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 CA-C-O 116.459 -2.301 . . . . 0.0 109.567 -179.767 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 110.116 -1.193 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.524 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 8.2 t -62.92 -39.98 58.3 Favored Pre-proline 0 N--CA 1.495 1.783 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.524 ' CD ' ' N ' ' A' ' 2' ' ' CYS . 6.0 Cg_exo -68.91 125.04 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 C-N-CA 122.506 2.138 . . . . 0.0 109.085 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -166.94 -170.71 1.61 Allowed 'General case' 0 N--CA 1.485 1.318 0 O-C-N 124.555 1.159 . . . . 0.0 109.791 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 pp -59.56 -173.82 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.955 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.3 mt -54.92 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.895 0.747 . . . . 0.0 112.228 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 77.4 mtp -101.88 94.74 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 114.422 -1.263 . . . . 0.0 107.958 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.17 147.87 42.21 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.02 0.825 . . . . 0.0 109.354 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.56 163.24 30.17 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.964 0.887 . . . . 0.0 112.517 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.11 -15.5 8.71 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.611 -2.086 . . . . 0.0 108.653 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -139.98 153.33 46.85 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-O 121.234 0.54 . . . . 0.0 111.066 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.17 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.137 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.2 p -71.56 9.62 0.8 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -51.38 -38.1 51.63 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 123.674 0.609 . . . . 0.0 112.141 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.5 m -79.06 -163.53 0.5 Allowed 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.174 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.95 141.23 18.26 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 123.843 0.715 . . . . 0.0 110.735 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.96 102.55 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.669 0.605 . . . . 0.0 112.309 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.61 -21.95 3.96 Favored Glycine 0 N--CA 1.498 2.794 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.811 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 5.6 m -79.28 172.95 13.09 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.26 1.028 . . . . 0.0 112.385 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.75 178.54 4.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-N 112.574 -2.103 . . . . 0.0 106.96 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.23 135.45 54.98 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.53 159.26 36.54 Favored Glycine 0 N--CA 1.481 1.634 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.229 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -51.9 -28.05 30.01 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 C-N-CA 122.09 1.86 . . . . 0.0 111.719 177.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 p30 -63.7 -9.15 12.65 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.96 -2.67 79.94 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 114.956 0.742 . . . . 0.0 114.956 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -113.36 162.69 15.77 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.29 0.567 . . . . 0.0 110.75 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.9 m -57.53 165.23 1.64 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.633 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 CA-C-O 116.516 -2.269 . . . . 0.0 110.552 179.947 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.372 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.9 t -70.03 132.84 88.17 Favored Pre-proline 0 N--CA 1.497 1.903 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.79 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -64.28 148.39 91.04 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 121.935 1.757 . . . . 0.0 110.416 169.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.97 86.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.792 1.307 . . . . 0.0 114.216 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 112.09 8.78 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.845 -1.071 . . . . 0.0 108.123 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -80.06 60.68 3.67 Favored 'General case' 0 N--CA 1.482 1.16 0 O-C-N 124.312 1.008 . . . . 0.0 110.819 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 32.5 mtp -143.7 142.74 31.11 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.502 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.74 139.02 36.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.587 1.179 . . . . 0.0 109.114 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.443 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 1.8 p -129.83 -173.85 3.15 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.379 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -139.72 -37.42 0.49 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.748 -1.114 . . . . 0.0 108.732 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -122.38 168.36 12.17 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.909 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.43 -67.66 0.31 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 p -61.95 -1.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 114.437 -1.256 . . . . 0.0 113.801 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.43 -41.41 66.04 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.7 m -92.76 -164.06 1.13 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 113.92 -1.491 . . . . 0.0 109.079 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.7 tt -57.83 133.78 55.71 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.174 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.91 110.04 0.23 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.746 0.654 . . . . 0.0 112.508 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.29 -27.35 4.79 Favored Glycine 0 N--CA 1.495 2.593 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.522 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 m -78.83 149.77 32.45 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.431 0.634 . . . . 0.0 111.66 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 m -111.35 153.69 13.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 CA-C-N 113.517 -1.674 . . . . 0.0 108.402 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 t -112.57 90.87 3.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 124.475 1.109 . . . . 0.0 109.523 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.59 170.56 27.28 Favored Glycine 0 N--CA 1.488 2.155 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.612 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -51.4 -26.62 21.74 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 C-N-CA 122.265 1.977 . . . . 0.0 113.132 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -57.03 -21.7 33.12 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.71 -19.8 48.93 Favored Glycine 0 N--CA 1.477 1.412 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -98.56 144.43 27.88 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 123.663 0.272 . . . . 0.0 110.282 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.3 144.89 55.64 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.946 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.919 0 CA-C-O 115.702 -2.721 . . . . 0.0 113.368 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.391 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t -147.08 85.42 6.93 Favored Pre-proline 0 N--CA 1.493 1.699 0 O-C-N 124.125 0.544 . . . . 0.0 109.835 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -64.35 125.22 14.65 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 121.986 1.791 . . . . 0.0 110.884 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.13 138.98 48.78 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.306 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.8 tp -168.61 148.85 4.54 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.581 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.52 95.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.485 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 40.7 ttm -160.2 105.3 1.51 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.299 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.69 139.87 58.42 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.5 p -100.95 128.96 46.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 ptmt -93.75 -20.19 20.35 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.95 157.75 42.2 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 114.476 -1.238 . . . . 0.0 107.795 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -54.19 -68.53 0.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.021 0.438 . . . . 0.0 111.13 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.4 p -73.33 17.67 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.756 -1.111 . . . . 0.0 113.733 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -53.3 -46.78 69.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.488 0.492 . . . . 0.0 111.688 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -79.31 -177.16 5.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.679 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.05 152.28 0.56 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.94 108.07 0.32 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.871 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.88 -22.86 4.01 Favored Glycine 0 N--CA 1.495 2.6 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.558 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.4 m -79.53 152.14 30.33 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.155 0.979 . . . . 0.0 112.767 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.4 m -144.02 151.39 16.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-N 112.539 -2.119 . . . . 0.0 105.905 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.9 t -101.66 100.56 10.96 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.306 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.31 -175.43 21.88 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -54.09 -13.97 5.51 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 122.093 1.862 . . . . 0.0 113.054 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.72 -20.5 66.37 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.68 -15.81 39.7 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.63 169.07 8.67 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.1 m -62.2 165.84 5.43 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.6 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.245 -179.675 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.373 0 N-CA-C 110.684 -0.966 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.21 135.3 79.68 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-N 115.114 -0.543 . . . . 0.0 110.376 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -66.4 139.68 55.16 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 121.96 1.773 . . . . 0.0 110.491 170.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.84 49.52 0.78 Allowed 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.39 107.07 0.52 Allowed 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.55 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.6 tt -62.96 93.37 0.06 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.3 ttp -140.92 143.14 34.43 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.173 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 142.43 58.4 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.357 1.036 . . . . 0.0 110.335 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' SG ' ' C ' ' A' ' 26' ' ' PHE . 31.3 p -155.89 175.06 14.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.796 0.685 . . . . 0.0 111.522 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -146.76 -11.04 0.45 Allowed 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -141.07 160.89 39.12 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 123.777 0.673 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.17 -64.3 0.88 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.8 p -61.79 -10.41 8.93 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.153 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.64 -46.26 58.27 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.68 0.613 . . . . 0.0 110.812 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.4 m -91.38 -166.11 1.5 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.156 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.53 141.19 32.16 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 123.715 0.634 . . . . 0.0 112.268 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 107.18 0.2 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.967 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.45 -20.58 5.82 Favored Glycine 0 N--CA 1.499 2.872 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.631 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.2 m -79.65 167.99 19.95 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.443 0.64 . . . . 0.0 112.398 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.6 m -130.16 157.92 42.65 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.75 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.1 t -114.0 87.84 2.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.987 0.804 . . . . 0.0 108.938 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.8 173.6 4.64 Favored Glycine 0 N--CA 1.49 2.299 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.414 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -53.72 -23.78 27.67 Favored 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 122.468 2.112 . . . . 0.0 113.19 -175.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -60.15 -14.28 16.39 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.73 9.44 87.06 Favored Glycine 0 N--CA 1.483 1.775 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.41 ' C ' ' SG ' ' A' ' 9' ' ' CYS . 7.4 m-85 -126.99 155.48 43.13 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.9 m -60.1 147.58 38.96 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.653 0.739 . . . . 0.0 110.639 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.416 0 CA-C-O 117.038 -1.979 . . . . 0.0 109.204 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 111.466 -0.654 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.1 t -123.59 84.5 53.2 Favored Pre-proline 0 N--CA 1.493 1.677 0 CA-C-N 114.027 -1.087 . . . . 0.0 109.353 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -60.77 145.8 98.37 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.474 2.116 . . . . 0.0 112.688 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.29 124.82 21.45 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.885 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.41 -172.9 0.18 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 124.304 1.002 . . . . 0.0 108.783 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.84 123.58 14.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 123.476 0.485 . . . . 0.0 109.825 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.4 mtt -86.27 49.77 1.86 Allowed 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.793 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -106.21 127.76 53.46 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.521 ' SG ' ' N ' ' A' ' 10' ' ' LYS . 0.5 OUTLIER -120.97 -161.02 0.87 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 123.956 0.785 . . . . 0.0 111.239 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.521 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 1.6 tptm -152.84 -26.32 0.15 Allowed 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.984 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -150.69 171.62 16.87 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -50.12 -75.16 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -78.68 18.14 0.62 Allowed 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.718 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.48 -36.2 68.83 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.618 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.4 m -79.15 -168.75 1.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.819 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.81 146.84 35.67 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.259 0.836 . . . . 0.0 113.259 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.57 104.34 0.06 Allowed 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.401 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.34 -30.7 2.5 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 2.8 m -82.87 157.48 23.08 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 122.184 0.993 . . . . 0.0 112.466 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.0 m -133.65 160.14 42.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 104.171 -2.529 . . . . 0.0 104.171 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.0 t -121.5 140.61 51.97 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.941 -0.704 . . . . 0.0 112.764 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.92 174.32 47.71 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 113.934 -1.485 . . . . 0.0 110.141 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -52.92 -30.42 48.08 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.091 1.861 . . . . 0.0 110.651 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -61.35 -9.55 5.53 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 113.662 -1.608 . . . . 0.0 114.196 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.18 17.79 76.1 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 111.9 -0.48 . . . . 0.0 111.9 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -117.19 144.0 45.24 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.967 -0.617 . . . . 0.0 109.794 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.0 m -74.12 146.74 43.31 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 124.311 1.007 . . . . 0.0 112.628 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 115.937 -2.59 . . . . 0.0 109.702 179.714 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 49.0 t -72.45 131.79 84.41 Favored Pre-proline 0 N--CA 1.496 1.83 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.397 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -67.0 137.57 44.98 Favored 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.722 1.615 . . . . 0.0 110.567 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -53.59 120.62 6.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 123.951 0.782 . . . . 0.0 112.862 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.4 tt -172.86 87.09 0.07 Allowed 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.47 95.27 1.36 Allowed 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.92 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.3 ptm -131.86 158.53 41.1 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.749 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.59 142.88 42.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.003 0.815 . . . . 0.0 108.964 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.473 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . 2.1 p -123.79 128.59 49.76 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 124.252 0.97 . . . . 0.0 112.128 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -82.71 -32.32 28.07 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.862 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -138.44 170.57 15.79 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.316 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -57.74 -60.48 3.63 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.023 0.44 . . . . 0.0 111.388 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.2 p -68.36 6.97 0.67 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.63 -45.85 63.43 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 123.47 0.481 . . . . 0.0 111.385 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -81.68 -177.14 6.42 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.487 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.92 147.46 12.19 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.044 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.34 106.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.647 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.85 -26.6 2.87 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.8 m -84.92 172.44 11.37 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.118 0.961 . . . . 0.0 111.973 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 m -141.67 165.92 17.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.887 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 t -92.98 108.91 20.37 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.207 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.16 115.86 6.18 Favored Glycine 0 N--CA 1.49 2.239 0 CA-C-O 118.23 -1.317 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.33 85.78 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 123.038 2.492 . . . . 0.0 112.19 -173.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.3 p30 177.98 -35.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.11 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.84 -42.71 0.62 Allowed Glycine 0 N--CA 1.482 1.75 0 O-C-N 123.986 0.804 . . . . 0.0 112.982 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -92.97 149.98 20.86 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 2.3 m -63.82 172.42 2.24 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 124.844 1.34 . . . . 0.0 113.019 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.469 0 CA-C-O 115.881 -2.621 . . . . 0.0 110.829 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.419 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 t -93.24 118.97 67.84 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 114.919 -0.641 . . . . 0.0 110.2 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.31 173.08 10.14 Favored 'Trans proline' 0 N--CA 1.487 1.136 0 C-N-CA 122.123 1.882 . . . . 0.0 110.541 171.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -42.12 148.84 0.17 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.31 109.97 1.55 Allowed 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.882 -1.053 . . . . 0.0 108.859 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.56 72.5 4.1 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 124.275 0.985 . . . . 0.0 109.929 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 57.1 mtp -138.54 139.32 38.65 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.35 133.91 51.48 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 123.817 0.698 . . . . 0.0 112.604 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.58 177.9 4.65 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.967 -1.47 . . . . 0.0 109.645 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -149.8 -26.78 0.26 Allowed 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.098 -1.41 . . . . 0.0 108.205 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -155.17 167.29 30.84 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.01 -67.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.019 0.438 . . . . 0.0 110.001 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.0 p -67.36 -3.16 7.42 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.808 -1.087 . . . . 0.0 113.286 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -52.21 -38.63 58.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 123.515 0.509 . . . . 0.0 112.128 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.6 m -97.27 -164.63 1.17 Allowed 'General case' 0 N--CA 1.484 1.272 0 O-C-N 124.651 1.219 . . . . 0.0 111.091 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.3 142.16 10.55 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 124.02 0.825 . . . . 0.0 111.684 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.1 113.03 0.98 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.871 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.28 -21.64 9.24 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.163 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -79.92 162.95 24.68 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 120.563 0.22 . . . . 0.0 110.971 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.8 m -134.76 154.78 37.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 O-C-N 124.312 1.008 . . . . 0.0 110.066 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.5 t -90.35 107.11 18.94 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.747 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.31 170.22 54.49 Favored Glycine 0 N--CA 1.484 1.86 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.927 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.98 -36.26 99.18 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.416 2.078 . . . . 0.0 111.22 177.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -65.99 -1.55 3.17 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.843 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.44 13.85 82.51 Favored Glycine 0 N--CA 1.482 1.711 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.951 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -110.35 149.24 30.5 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.178 0.513 . . . . 0.0 111.605 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.0 m -62.54 165.96 5.74 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.153 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.84 0 CA-C-O 117.669 -1.629 . . . . 0.0 112.868 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.4 t -139.89 91.06 10.54 Favored Pre-proline 0 N--CA 1.491 1.599 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.246 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -64.09 -176.03 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.577 2.185 . . . . 0.0 113.235 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -48.1 119.42 2.9 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.106 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.85 132.86 45.91 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.303 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.01 44.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.378 -1.283 . . . . 0.0 108.127 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.75 139.64 27.99 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.48 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.01 147.46 32.87 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.176 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.2 p -138.0 141.6 40.44 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.8 18.02 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.126 -1.397 . . . . 0.0 109.186 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -139.52 174.51 10.44 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.754 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.68 -53.11 61.35 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.282 0.563 . . . . 0.0 109.749 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 p -57.49 -11.83 2.24 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.182 -1.372 . . . . 0.0 114.184 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -49.0 -47.14 44.59 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 123.894 0.746 . . . . 0.0 112.223 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.5 m -90.82 177.91 6.19 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.487 1.117 . . . . 0.0 110.338 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.5 155.44 40.58 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.921 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.63 112.31 0.58 Allowed 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 134.7 -34.59 2.32 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -90.6 155.49 18.82 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.719 0.771 . . . . 0.0 111.235 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.1 m -128.96 167.65 23.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 CA-C-N 113.222 -1.808 . . . . 0.0 107.506 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 t -111.19 111.68 22.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 123.674 0.609 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.73 147.81 26.91 Favored Glycine 0 CA--C 1.541 1.705 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -52.45 -21.49 14.06 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.315 2.01 . . . . 0.0 113.145 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -56.43 -27.08 55.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 124.132 0.895 . . . . 0.0 113.26 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 122.54 -38.96 2.4 Favored Glycine 0 N--CA 1.481 1.676 0 O-C-N 123.947 0.779 . . . . 0.0 111.205 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -93.59 158.08 15.87 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 115.233 -0.484 . . . . 0.0 111.301 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.89 178.28 2.25 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.747 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 179.833 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 24.3 mmm . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.81 138.05 58.15 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 124.579 1.174 . . . . 0.0 111.837 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -126.46 163.8 22.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 124.319 1.012 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -138.69 -20.97 1.01 Allowed 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.288 -1.778 . . . . 0.0 108.393 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -145.34 163.25 35.13 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.388 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -57.31 -57.65 11.69 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.527 0.68 . . . . 0.0 109.948 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.3 p -54.63 -13.12 0.89 Allowed 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 113.879 -1.51 . . . . 0.0 114.458 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -47.12 -45.72 22.49 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.029 0.831 . . . . 0.0 112.113 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.2 m -89.57 -169.69 2.57 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.991 -1.913 . . . . 0.0 111.471 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mt -75.78 144.97 41.09 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.549 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.03 106.92 0.1 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 124.238 0.962 . . . . 0.0 111.24 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.77 -35.33 1.79 Allowed Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 3.8 m -89.02 172.13 9.34 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.742 0.782 . . . . 0.0 111.301 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.2 m -135.6 167.23 25.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 CA-C-N 113.293 -1.776 . . . . 0.0 107.028 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 t -74.96 98.11 3.51 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.238 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.503 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -49.2 112.06 1.19 Allowed Glycine 0 N--CA 1.494 2.5 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.39 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo -62.19 85.99 0.1 Allowed 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 123.321 2.681 . . . . 0.0 110.675 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -179.76 -35.58 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.198 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.08 -53.46 0.4 Allowed Glycine 0 N--CA 1.48 1.619 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -96.96 162.21 13.49 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.114 -0.543 . . . . 0.0 111.026 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.503 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 63.8 m -51.25 159.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 125.002 1.439 . . . . 0.0 113.205 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.642 0 CA-C-O 117.297 -1.835 . . . . 0.0 111.048 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.967 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.28 129.09 40.39 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.759 0.662 . . . . 0.0 109.796 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER -138.73 133.63 32.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.003 0.814 . . . . 0.0 111.73 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -85.53 -28.03 25.2 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.212 -1.358 . . . . 0.0 109.712 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -132.78 165.73 23.88 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.314 1.009 . . . . 0.0 110.115 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.4 -56.65 17.91 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.0 p -65.64 1.69 1.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.972 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.86 -46.23 51.28 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.659 0.6 . . . . 0.0 111.703 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.1 m -85.04 -178.21 6.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.026 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 143.76 43.62 Favored 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.832 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.68 103.56 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.154 0.909 . . . . 0.0 111.318 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 142.62 -32.39 1.95 Allowed Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -79.85 166.46 21.67 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.965 0.412 . . . . 0.0 109.974 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.3 m -146.39 147.33 18.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.851 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -104.91 118.26 36.09 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 113.44 -1.709 . . . . 0.0 108.736 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.74 178.42 53.3 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -51.57 -24.06 16.25 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.869 1.712 . . . . 0.0 111.372 170.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -60.68 -18.91 56.81 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.323 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.66 5.1 89.76 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -122.35 143.89 49.36 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.336 0.589 . . . . 0.0 110.134 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 73.2 m -64.4 172.5 2.53 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.159 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.677 0 CA-C-O 116.527 -2.263 . . . . 0.0 110.2 179.768 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 46.2 ttm . . . . . 0 N--CA 1.497 1.907 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.32 150.37 33.29 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.367 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.0 155.22 19.6 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.774 0.797 . . . . 0.0 111.183 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -124.12 -19.56 5.56 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.078 -1.874 . . . . 0.0 107.413 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -150.86 154.27 36.9 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -53.81 -44.3 70.08 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.141 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.8 p -79.2 22.46 0.41 Allowed 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.443 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -52.68 -36.37 56.93 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -93.34 -173.78 3.33 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.204 0.94 . . . . 0.0 110.821 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD12 ' A' ' 16' ' ' LEU . 5.1 mp -57.3 147.43 25.62 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.712 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.21 108.02 0.17 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.695 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.57 -32.78 2.35 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.2 m -81.11 165.18 21.84 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.012 -0.594 . . . . 0.0 110.057 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.55 154.39 12.39 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.269 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -84.34 140.56 31.51 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.89 168.21 24.63 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -52.77 -28.7 39.3 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 122.1 1.867 . . . . 0.0 111.743 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p30 -60.4 -15.72 28.9 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.815 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.58 0.09 79.61 Favored Glycine 0 N--CA 1.481 1.654 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -110.02 163.44 13.57 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -58.41 173.59 0.37 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.874 0.845 . . . . 0.0 111.87 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.45 0 CA-C-O 116.156 -2.469 . . . . 0.0 109.559 179.961 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -72.14 145.44 48.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.473 1.108 . . . . 0.0 110.824 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.73 166.89 10.35 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.558 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -118.6 -26.48 6.15 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 113.403 -1.726 . . . . 0.0 107.21 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.472 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 0.3 OUTLIER -152.34 172.62 16.18 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.827 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.2 -56.91 16.12 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.343 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.7 p -71.77 3.04 4.5 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.4 t70 -48.18 -46.18 34.55 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -78.51 -171.72 2.59 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.6 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 mt -47.9 141.29 5.9 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.92 107.04 0.22 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.614 0.571 . . . . 0.0 110.958 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.58 -21.92 4.19 Favored Glycine 0 N--CA 1.498 2.769 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.236 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.2 m -78.95 173.93 12.05 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.147 0.975 . . . . 0.0 111.532 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.6 m -143.04 170.04 11.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-N 112.765 -2.016 . . . . 0.0 106.564 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 t -114.95 140.38 49.05 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -97.37 160.18 21.26 Favored Glycine 0 CA--C 1.538 1.478 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -52.01 -22.41 14.46 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.919 1.746 . . . . 0.0 112.409 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.41 ' ND2' ' HB2' ' A' ' 26' ' ' PHE . 18.9 p-10 -60.62 -14.82 22.65 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.43 -21.46 46.0 Favored Glycine 0 N--CA 1.48 1.584 0 O-C-N 123.687 0.617 . . . . 0.0 112.117 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.41 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 30.9 m-85 -102.04 168.62 9.27 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 120.776 0.322 . . . . 0.0 110.783 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 72.1 m -50.55 164.61 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 124.547 1.154 . . . . 0.0 111.207 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 -179.538 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.19 146.24 39.27 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 124.758 1.286 . . . . 0.0 110.754 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 4.2 p -139.42 -172.8 3.44 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.097 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -158.74 -13.79 0.07 Allowed 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.592 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -131.5 159.72 37.3 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.84 -65.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 82.5 p -72.05 9.13 1.02 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.135 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -50.2 -48.92 54.04 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 123.674 0.609 . . . . 0.0 111.28 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 3.9 m -86.21 -166.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 114.053 -1.431 . . . . 0.0 111.669 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.45 ' H ' HD12 ' A' ' 16' ' ' LEU . 2.4 mp -50.78 134.95 24.6 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.047 0.842 . . . . 0.0 111.91 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.81 109.04 0.21 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 123.659 0.6 . . . . 0.0 112.086 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 131.54 -30.08 3.33 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 25.5 m -81.53 161.51 23.56 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.471 0.653 . . . . 0.0 110.595 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.3 m -132.92 161.88 40.9 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 CA-C-N 113.91 -1.496 . . . . 0.0 108.004 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 t -105.59 119.34 38.87 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.92 172.98 48.53 Favored Glycine 0 N--CA 1.481 1.674 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.76 -20.18 42.02 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.748 1.632 . . . . 0.0 111.099 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.509 HD22 ' HB2' ' A' ' 26' ' ' PHE . 7.8 p-10 -66.09 -10.29 39.11 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.183 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.18 -7.53 67.05 Favored Glycine 0 N--CA 1.483 1.781 0 CA-C-O 119.903 -0.387 . . . . 0.0 114.006 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HB2' HD22 ' A' ' 24' ' ' ASN . 5.5 m-85 -115.1 161.11 18.83 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.466 0.65 . . . . 0.0 110.687 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -68.24 143.31 55.33 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.473 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 115.9 -2.611 . . . . 0.0 107.594 179.628 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 42.1 mtt . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -72.63 146.98 46.23 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.122 0.889 . . . . 0.0 111.255 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.8 p -141.68 162.13 36.24 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.108 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -131.19 -6.55 3.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 113.65 -1.614 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 10.2 mm-40 -133.96 153.28 51.88 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.982 0.801 . . . . 0.0 110.876 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.19 -61.1 2.8 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.4 p -69.09 4.46 1.58 Allowed 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.992 -1.458 . . . . 0.0 112.849 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 22.3 t0 -53.36 -45.44 69.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.519 0.512 . . . . 0.0 110.636 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.2 -174.67 5.18 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 124.188 0.93 . . . . 0.0 110.059 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.31 162.82 21.96 Favored 'General case' 0 N--CA 1.499 2.02 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.95 124.37 8.59 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.118 -1.401 . . . . 0.0 112.262 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.34 -24.8 21.72 Favored Glycine 0 N--CA 1.495 2.621 0 O-C-N 124.574 1.171 . . . . 0.0 112.226 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.3 m -86.37 170.43 12.02 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.718 0.77 . . . . 0.0 112.075 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -146.47 161.13 10.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.493 -1.685 . . . . 0.0 106.52 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.94 101.27 8.52 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.838 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.425 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -53.29 115.23 4.46 Favored Glycine 0 N--CA 1.491 2.314 0 CA-C-O 118.374 -1.237 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -59.53 87.88 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.182 0 C-N-CA 122.833 2.355 . . . . 0.0 110.835 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -177.67 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 112.13 -2.304 . . . . 0.0 107.94 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 152.94 -49.31 0.52 Allowed Glycine 0 N--CA 1.482 1.753 0 O-C-N 124.094 0.871 . . . . 0.0 111.933 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.67 161.14 14.16 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.469 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 92.8 m -63.6 165.17 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.557 1.161 . . . . 0.0 110.564 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.018 -1.99 . . . . 0.0 110.456 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.893 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -65.77 145.08 56.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 124.653 1.22 . . . . 0.0 110.697 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.5 p -124.67 119.46 29.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.067 0.854 . . . . 0.0 112.769 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.11 -20.72 26.67 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.068 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -136.25 161.86 34.6 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.301 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.23 -49.73 75.93 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -78.42 16.8 0.74 Allowed 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.163 -1.835 . . . . 0.0 113.272 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.7 -49.26 73.45 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.316 0.385 . . . . 0.0 110.794 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -81.62 -176.28 5.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.087 0.867 . . . . 0.0 110.303 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.96 151.58 21.6 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.56 111.0 0.57 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.557 -1.201 . . . . 0.0 110.724 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.13 -30.97 2.75 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -83.41 178.15 8.16 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 121.422 0.629 . . . . 0.0 110.885 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -151.43 166.08 2.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-N 114.091 -1.413 . . . . 0.0 107.332 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.36 105.14 17.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.67 0.606 . . . . 0.0 109.562 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.16 146.56 44.65 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -51.2 -24.73 15.75 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.305 2.003 . . . . 0.0 112.865 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.57 -19.23 14.82 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 111.77 -25.6 12.92 Favored Glycine 0 N--CA 1.482 1.745 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.05 164.98 11.34 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.196 -0.502 . . . . 0.0 109.661 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.8 m -63.01 158.62 18.97 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 CA-C-O 116.174 -2.459 . . . . 0.0 107.696 -179.828 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.9 mtt . . . . . 0 N--CA 1.496 1.864 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 30.0 mtm-85 -70.4 132.01 44.96 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.849 1.343 . . . . 0.0 109.986 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.73 177.67 4.78 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.874 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -136.55 -11.62 1.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.942 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -156.89 166.84 32.23 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -52.96 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -79.36 18.09 0.75 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.917 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -53.77 -38.84 64.86 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.485 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 m -79.48 -166.22 0.93 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.737 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -48.65 141.1 7.49 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.71 0.631 . . . . 0.0 112.543 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.5 107.84 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.001 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.47 -23.51 4.53 Favored Glycine 0 N--CA 1.497 2.758 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -79.6 160.03 26.57 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 122.063 0.935 . . . . 0.0 112.919 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.4 m -130.79 159.93 42.41 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 CA-C-N 112.751 -2.022 . . . . 0.0 106.089 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -119.7 87.9 2.83 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.09 176.43 3.65 Favored Glycine 0 N--CA 1.49 2.273 0 CA-C-N 115.685 -0.688 . . . . 0.0 113.322 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.54 86.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.884 2.389 . . . . 0.0 110.103 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 p30 179.65 -25.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 112.938 -1.937 . . . . 0.0 109.188 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.23 19.93 76.12 Favored Glycine 0 N--CA 1.487 2.069 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.832 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.404 ' CZ ' ' HG3' ' A' ' 8' ' ' ARG . 10.4 m-85 -124.85 147.55 48.7 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -61.65 136.4 57.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.153 -1.019 . . . . 0.0 108.679 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 116.115 -2.492 . . . . 0.0 108.335 -179.847 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 82.9 mtp . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -66.57 151.3 47.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.231 0.957 . . . . 0.0 110.401 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.4 t -100.08 172.03 7.45 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.015 0.912 . . . . 0.0 112.55 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -160.5 13.39 0.11 Allowed 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 113.077 -1.874 . . . . 0.0 108.252 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 140.07 169.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 126.867 2.067 . . . . 0.0 108.907 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.81 -55.46 26.37 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.552 0.691 . . . . 0.0 109.444 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.4 p -62.11 -14.2 34.36 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 113.817 -1.538 . . . . 0.0 114.43 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -50.82 -49.2 59.21 Favored 'General case' 0 N--CA 1.503 2.18 0 CA-C-O 121.886 0.85 . . . . 0.0 111.339 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -79.6 -170.85 2.53 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.858 -1.974 . . . . 0.0 109.538 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.65 141.07 53.69 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.32 103.54 0.05 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 123.836 0.71 . . . . 0.0 110.803 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.83 -31.64 1.61 Allowed Glycine 0 N--CA 1.496 2.652 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.1 m -79.97 -169.84 2.19 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.1 m -145.74 179.58 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -99.63 94.9 6.61 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.383 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.07 109.62 2.55 Favored Glycine 0 N--CA 1.489 2.169 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.089 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -50.3 -27.01 16.85 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.641 2.227 . . . . 0.0 113.908 -165.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -52.05 -32.75 35.89 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.863 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.82 -33.62 1.27 Allowed Glycine 0 N--CA 1.485 1.955 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -101.06 174.65 5.9 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.932 -0.634 . . . . 0.0 109.563 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 65.0 m -61.01 179.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.304 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.832 0 CA-C-O 116.451 -2.305 . . . . 0.0 113.659 -179.879 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 ptp . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.81 131.39 50.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.996 0.81 . . . . 0.0 111.902 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -93.16 -159.4 0.68 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.754 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 -18.37 0.09 Allowed 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 113.975 -1.466 . . . . 0.0 108.592 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.42 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 10.8 mt-30 -160.45 168.4 25.21 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -58.07 -62.78 1.57 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.841 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.9 p -77.02 24.56 0.16 Allowed 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.413 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 4.4 t70 -48.72 -52.83 21.51 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.78 -178.88 7.01 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-N 113.757 -1.565 . . . . 0.0 112.321 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -53.49 146.08 13.48 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.27 102.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.875 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 144.29 -34.0 1.66 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 108.731 -1.748 . . . . 0.0 108.731 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.5 m -86.31 163.14 17.87 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 114.948 -0.626 . . . . 0.0 109.328 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.1 155.11 6.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.705 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.8 t -98.02 128.08 44.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.65 1.219 . . . . 0.0 109.639 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -91.51 178.41 41.3 Favored Glycine 0 N--CA 1.479 1.547 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -53.26 -26.42 34.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.968 1.779 . . . . 0.0 110.734 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -59.88 -14.93 17.58 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.25 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.49 -13.0 54.03 Favored Glycine 0 N--CA 1.481 1.638 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -101.16 153.53 19.51 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.242 0.544 . . . . 0.0 111.584 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.41 178.31 2.98 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.549 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.801 0 CA-C-O 114.96 -3.133 . . . . 0.0 114.414 179.784 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.3 mmm . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.79 143.98 57.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 124.162 0.914 . . . . 0.0 108.877 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -118.07 -161.23 0.82 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.217 0.948 . . . . 0.0 111.581 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 -23.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.516 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.451 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 57.4 mt-30 -148.6 167.08 26.4 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.077 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.61 -54.07 45.05 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -74.73 8.42 2.42 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.771 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.451 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 7.0 t70 -48.76 -49.02 40.4 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 123.664 0.603 . . . . 0.0 111.584 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.5 m -84.54 -179.53 7.17 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.764 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.22 145.82 7.5 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.68 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.07 -30.21 2.85 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 109.349 -1.501 . . . . 0.0 109.349 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 80.3 m -79.89 152.87 29.38 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.155 0.502 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -136.19 150.0 27.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.504 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -119.61 120.73 37.53 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.378 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.29 178.82 53.79 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -49.93 -24.54 10.65 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 121.941 1.761 . . . . 0.0 111.795 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -57.93 -19.54 30.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.276 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.86 18.11 77.56 Favored Glycine 0 N--CA 1.486 1.973 0 O-C-N 123.492 0.495 . . . . 0.0 113.583 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -127.28 142.57 51.43 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 54.0 m -71.17 170.35 13.17 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 124.509 1.131 . . . . 0.0 110.892 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.72 0 CA-C-O 117.285 -1.842 . . . . 0.0 109.581 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.5 mmt . . . . . 0 N--CA 1.496 1.836 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.17 137.86 51.33 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 124.42 1.075 . . . . 0.0 109.376 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 2.9 p -137.63 -167.12 2.07 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.21 0.944 . . . . 0.0 111.6 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -159.91 -9.14 0.06 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -143.51 165.86 26.41 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.764 0.665 . . . . 0.0 109.894 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -54.97 -70.01 0.12 Allowed 'General case' 0 N--CA 1.49 1.575 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.908 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.1 p -74.76 11.67 1.0 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.957 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -52.73 -43.43 65.71 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 123.578 0.549 . . . . 0.0 110.696 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.6 m -92.48 -163.11 1.0 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.995 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.68 138.83 58.62 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.514 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.46 105.1 0.08 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 124.255 0.972 . . . . 0.0 111.548 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 143.65 -34.35 1.7 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.28 -1.528 . . . . 0.0 109.28 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -86.71 164.24 16.87 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 124.012 0.477 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.3 m -146.88 147.0 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 O-C-N 124.302 1.001 . . . . 0.0 109.638 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.14 141.36 35.98 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.003 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -140.8 -161.93 8.9 Favored Glycine 0 N--CA 1.483 1.776 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -53.56 -25.89 34.66 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.089 1.859 . . . . 0.0 112.74 -174.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -61.4 -19.38 61.84 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.15 -13.41 20.37 Favored Glycine 0 N--CA 1.482 1.711 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -105.86 155.41 19.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.963 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 58.5 m -60.76 166.94 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.415 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 CA-C-O 116.459 -2.301 . . . . 0.0 109.567 -179.767 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 77.4 mtp . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.17 147.87 42.21 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.02 0.825 . . . . 0.0 109.354 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.56 163.24 30.17 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.964 0.887 . . . . 0.0 112.517 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.11 -15.5 8.71 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.611 -2.086 . . . . 0.0 108.653 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -139.98 153.33 46.85 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-O 121.234 0.54 . . . . 0.0 111.066 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.17 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.137 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.2 p -71.56 9.62 0.8 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -51.38 -38.1 51.63 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 123.674 0.609 . . . . 0.0 112.141 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.5 m -79.06 -163.53 0.5 Allowed 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.174 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.95 141.23 18.26 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 123.843 0.715 . . . . 0.0 110.735 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.96 102.55 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.669 0.605 . . . . 0.0 112.309 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.61 -21.95 3.96 Favored Glycine 0 N--CA 1.498 2.794 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.811 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 5.6 m -79.28 172.95 13.09 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.26 1.028 . . . . 0.0 112.385 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.75 178.54 4.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-N 112.574 -2.103 . . . . 0.0 106.96 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.23 135.45 54.98 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.53 159.26 36.54 Favored Glycine 0 N--CA 1.481 1.634 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.229 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -51.9 -28.05 30.01 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 C-N-CA 122.09 1.86 . . . . 0.0 111.719 177.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 p30 -63.7 -9.15 12.65 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.96 -2.67 79.94 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 114.956 0.742 . . . . 0.0 114.956 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -113.36 162.69 15.77 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.29 0.567 . . . . 0.0 110.75 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.9 m -57.53 165.23 1.64 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.633 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 CA-C-O 116.516 -2.269 . . . . 0.0 110.552 179.947 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 32.5 mtp . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.74 139.02 36.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.587 1.179 . . . . 0.0 109.114 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 1.8 p -129.83 -173.85 3.15 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.379 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -139.72 -37.42 0.49 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.748 -1.114 . . . . 0.0 108.732 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.428 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 6.8 mm100 -122.38 168.36 12.17 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.909 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.452 ' OD2' HG12 ' A' ' 20' ' ' VAL . 12.4 t70 -57.43 -67.66 0.31 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 p -61.95 -1.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 114.437 -1.256 . . . . 0.0 113.801 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.428 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.1 t70 -53.43 -41.41 66.04 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.7 m -92.76 -164.06 1.13 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 113.92 -1.491 . . . . 0.0 109.079 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.7 tt -57.83 133.78 55.71 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.174 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.91 110.04 0.23 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.746 0.654 . . . . 0.0 112.508 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.29 -27.35 4.79 Favored Glycine 0 N--CA 1.495 2.593 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.522 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 m -78.83 149.77 32.45 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.431 0.634 . . . . 0.0 111.66 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.452 HG12 ' OD2' ' A' ' 12' ' ' ASP . 35.1 m -111.35 153.69 13.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 CA-C-N 113.517 -1.674 . . . . 0.0 108.402 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 t -112.57 90.87 3.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 124.475 1.109 . . . . 0.0 109.523 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.59 170.56 27.28 Favored Glycine 0 N--CA 1.488 2.155 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.612 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -51.4 -26.62 21.74 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 C-N-CA 122.265 1.977 . . . . 0.0 113.132 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -57.03 -21.7 33.12 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.71 -19.8 48.93 Favored Glycine 0 N--CA 1.477 1.412 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -98.56 144.43 27.88 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 123.663 0.272 . . . . 0.0 110.282 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.3 144.89 55.64 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.946 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.919 0 CA-C-O 115.702 -2.721 . . . . 0.0 113.368 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 40.7 ttm . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.493 HH21 ' H ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -65.69 139.87 58.42 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.835 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.5 p -100.95 128.96 46.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 ptmt -93.75 -20.19 20.35 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.95 157.75 42.2 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 114.476 -1.238 . . . . 0.0 107.795 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -54.19 -68.53 0.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.021 0.438 . . . . 0.0 111.13 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.4 p -73.33 17.67 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.756 -1.111 . . . . 0.0 113.733 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -53.3 -46.78 69.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.488 0.492 . . . . 0.0 111.688 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -79.31 -177.16 5.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.679 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.05 152.28 0.56 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.94 108.07 0.32 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.871 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.88 -22.86 4.01 Favored Glycine 0 N--CA 1.495 2.6 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.558 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.4 m -79.53 152.14 30.33 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.155 0.979 . . . . 0.0 112.767 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.4 m -144.02 151.39 16.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-N 112.539 -2.119 . . . . 0.0 105.905 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.9 t -101.66 100.56 10.96 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.306 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.31 -175.43 21.88 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -54.09 -13.97 5.51 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 122.093 1.862 . . . . 0.0 113.054 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -64.72 -20.5 66.37 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.68 -15.81 39.7 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.63 169.07 8.67 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.1 m -62.2 165.84 5.43 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.6 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.245 -179.675 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.3 ttp . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 142.43 58.4 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.357 1.036 . . . . 0.0 110.335 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.41 ' SG ' ' C ' ' A' ' 26' ' ' PHE . 31.3 p -155.89 175.06 14.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.796 0.685 . . . . 0.0 111.522 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -146.76 -11.04 0.45 Allowed 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -141.07 160.89 39.12 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 123.777 0.673 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.17 -64.3 0.88 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.8 p -61.79 -10.41 8.93 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.153 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.64 -46.26 58.27 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.68 0.613 . . . . 0.0 110.812 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.4 m -91.38 -166.11 1.5 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.156 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.53 141.19 32.16 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 123.715 0.634 . . . . 0.0 112.268 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 107.18 0.2 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.967 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.45 -20.58 5.82 Favored Glycine 0 N--CA 1.499 2.872 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.631 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.2 m -79.65 167.99 19.95 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.443 0.64 . . . . 0.0 112.398 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.6 m -130.16 157.92 42.65 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.75 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.1 t -114.0 87.84 2.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.987 0.804 . . . . 0.0 108.938 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.8 173.6 4.64 Favored Glycine 0 N--CA 1.49 2.299 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.414 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -53.72 -23.78 27.67 Favored 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 122.468 2.112 . . . . 0.0 113.19 -175.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -60.15 -14.28 16.39 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.73 9.44 87.06 Favored Glycine 0 N--CA 1.483 1.775 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.41 ' C ' ' SG ' ' A' ' 9' ' ' CYS . 7.4 m-85 -126.99 155.48 43.13 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.9 m -60.1 147.58 38.96 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.653 0.739 . . . . 0.0 110.639 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.416 0 CA-C-O 117.038 -1.979 . . . . 0.0 109.204 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.4 mtt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 120.29 0.09 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -106.21 127.76 53.46 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.521 ' SG ' ' N ' ' A' ' 10' ' ' LYS . 0.5 OUTLIER -120.97 -161.02 0.87 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 123.956 0.785 . . . . 0.0 111.239 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.521 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 1.6 tptm -152.84 -26.32 0.15 Allowed 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.984 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.423 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 mp0 -150.69 171.62 16.87 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -50.12 -75.16 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -78.68 18.14 0.62 Allowed 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.718 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 30.9 t70 -56.48 -36.2 68.83 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.618 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.4 m -79.15 -168.75 1.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.819 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.81 146.84 35.67 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.259 0.836 . . . . 0.0 113.259 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.57 104.34 0.06 Allowed 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.401 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.34 -30.7 2.5 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 2.8 m -82.87 157.48 23.08 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 122.184 0.993 . . . . 0.0 112.466 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.0 m -133.65 160.14 42.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 104.171 -2.529 . . . . 0.0 104.171 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.0 t -121.5 140.61 51.97 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.941 -0.704 . . . . 0.0 112.764 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.92 174.32 47.71 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 113.934 -1.485 . . . . 0.0 110.141 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -52.92 -30.42 48.08 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.091 1.861 . . . . 0.0 110.651 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -61.35 -9.55 5.53 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 113.662 -1.608 . . . . 0.0 114.196 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.18 17.79 76.1 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 111.9 -0.48 . . . . 0.0 111.9 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -117.19 144.0 45.24 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.967 -0.617 . . . . 0.0 109.794 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.0 m -74.12 146.74 43.31 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 124.311 1.007 . . . . 0.0 112.628 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 115.937 -2.59 . . . . 0.0 109.702 179.714 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.3 ptm . . . . . 0 N--CA 1.499 1.993 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.59 142.88 42.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.003 0.815 . . . . 0.0 108.964 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . 2.1 p -123.79 128.59 49.76 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 124.252 0.97 . . . . 0.0 112.128 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -82.71 -32.32 28.07 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.862 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -138.44 170.57 15.79 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.316 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -57.74 -60.48 3.63 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.023 0.44 . . . . 0.0 111.388 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.2 p -68.36 6.97 0.67 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.63 -45.85 63.43 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 123.47 0.481 . . . . 0.0 111.385 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -81.68 -177.14 6.42 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.487 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.92 147.46 12.19 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.044 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.34 106.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.647 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.85 -26.6 2.87 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.8 m -84.92 172.44 11.37 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.118 0.961 . . . . 0.0 111.973 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 m -141.67 165.92 17.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.887 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 t -92.98 108.91 20.37 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.207 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.16 115.86 6.18 Favored Glycine 0 N--CA 1.49 2.239 0 CA-C-O 118.23 -1.317 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.33 85.78 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 123.038 2.492 . . . . 0.0 112.19 -173.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.3 p30 177.98 -35.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.11 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.84 -42.71 0.62 Allowed Glycine 0 N--CA 1.482 1.75 0 O-C-N 123.986 0.804 . . . . 0.0 112.982 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -92.97 149.98 20.86 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.484 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 2.3 m -63.82 172.42 2.24 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 124.844 1.34 . . . . 0.0 113.019 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.469 0 CA-C-O 115.881 -2.621 . . . . 0.0 110.829 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 57.1 mtp . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.35 133.91 51.48 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 123.817 0.698 . . . . 0.0 112.604 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.58 177.9 4.65 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.967 -1.47 . . . . 0.0 109.645 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -149.8 -26.78 0.26 Allowed 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.098 -1.41 . . . . 0.0 108.205 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -155.17 167.29 30.84 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.01 -67.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.019 0.438 . . . . 0.0 110.001 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.0 p -67.36 -3.16 7.42 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.808 -1.087 . . . . 0.0 113.286 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -52.21 -38.63 58.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 123.515 0.509 . . . . 0.0 112.128 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.6 m -97.27 -164.63 1.17 Allowed 'General case' 0 N--CA 1.484 1.272 0 O-C-N 124.651 1.219 . . . . 0.0 111.091 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.3 142.16 10.55 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 124.02 0.825 . . . . 0.0 111.684 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.1 113.03 0.98 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.871 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.28 -21.64 9.24 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.163 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -79.92 162.95 24.68 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 120.563 0.22 . . . . 0.0 110.971 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.8 m -134.76 154.78 37.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 O-C-N 124.312 1.008 . . . . 0.0 110.066 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.5 t -90.35 107.11 18.94 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.747 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.31 170.22 54.49 Favored Glycine 0 N--CA 1.484 1.86 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.927 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.98 -36.26 99.18 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.416 2.078 . . . . 0.0 111.22 177.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -65.99 -1.55 3.17 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.843 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.44 13.85 82.51 Favored Glycine 0 N--CA 1.482 1.711 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.951 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -110.35 149.24 30.5 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.178 0.513 . . . . 0.0 111.605 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.0 m -62.54 165.96 5.74 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.153 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.84 0 CA-C-O 117.669 -1.629 . . . . 0.0 112.868 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.978 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.01 147.46 32.87 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.176 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.2 p -138.0 141.6 40.44 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.8 18.02 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.126 -1.397 . . . . 0.0 109.186 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -139.52 174.51 10.44 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.754 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.68 -53.11 61.35 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.282 0.563 . . . . 0.0 109.749 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 p -57.49 -11.83 2.24 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.182 -1.372 . . . . 0.0 114.184 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -49.0 -47.14 44.59 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 123.894 0.746 . . . . 0.0 112.223 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.5 m -90.82 177.91 6.19 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.487 1.117 . . . . 0.0 110.338 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.5 155.44 40.58 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.921 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.63 112.31 0.58 Allowed 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 134.7 -34.59 2.32 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -90.6 155.49 18.82 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.719 0.771 . . . . 0.0 111.235 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.1 m -128.96 167.65 23.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 CA-C-N 113.222 -1.808 . . . . 0.0 107.506 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 t -111.19 111.68 22.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 123.674 0.609 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.73 147.81 26.91 Favored Glycine 0 CA--C 1.541 1.705 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -52.45 -21.49 14.06 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.315 2.01 . . . . 0.0 113.145 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.416 ' H ' HD22 ' A' ' 24' ' ' ASN . 1.6 p30 -56.43 -27.08 55.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 124.132 0.895 . . . . 0.0 113.26 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 122.54 -38.96 2.4 Favored Glycine 0 N--CA 1.481 1.676 0 O-C-N 123.947 0.779 . . . . 0.0 111.205 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -93.59 158.08 15.87 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 115.233 -0.484 . . . . 0.0 111.301 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.89 178.28 2.25 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.747 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 179.833 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 110.048 -1.221 . . . . 0.0 110.048 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 t -126.63 104.15 24.36 Favored Pre-proline 0 N--CA 1.496 1.867 0 CA-C-N 114.924 -0.638 . . . . 0.0 109.919 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -67.01 -168.3 0.16 Allowed 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.864 1.709 . . . . 0.0 111.88 173.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -159.49 137.25 10.08 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.756 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 178.62 171.06 0.81 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.46 -1.246 . . . . 0.0 108.517 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.34 83.16 0.15 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.865 0.84 . . . . 0.0 110.291 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 24.3 mmm -124.96 103.97 8.32 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.81 138.05 58.15 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 124.579 1.174 . . . . 0.0 111.837 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -126.46 163.8 22.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 124.319 1.012 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -138.69 -20.97 1.01 Allowed 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.288 -1.778 . . . . 0.0 108.393 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -145.34 163.25 35.13 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.388 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -57.31 -57.65 11.69 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.527 0.68 . . . . 0.0 109.948 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.3 p -54.63 -13.12 0.89 Allowed 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 113.879 -1.51 . . . . 0.0 114.458 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -47.12 -45.72 22.49 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.029 0.831 . . . . 0.0 112.113 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.2 m -89.57 -169.69 2.57 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.991 -1.913 . . . . 0.0 111.471 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mt -75.78 144.97 41.09 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.549 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.03 106.92 0.1 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 124.238 0.962 . . . . 0.0 111.24 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.77 -35.33 1.79 Allowed Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 3.8 m -89.02 172.13 9.34 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.742 0.782 . . . . 0.0 111.301 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.2 m -135.6 167.23 25.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 CA-C-N 113.293 -1.776 . . . . 0.0 107.028 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 t -74.96 98.11 3.51 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.238 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.503 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -49.2 112.06 1.19 Allowed Glycine 0 N--CA 1.494 2.5 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.39 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo -62.19 85.99 0.1 Allowed 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 123.321 2.681 . . . . 0.0 110.675 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -179.76 -35.58 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.198 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.08 -53.46 0.4 Allowed Glycine 0 N--CA 1.48 1.619 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -96.96 162.21 13.49 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.114 -0.543 . . . . 0.0 111.026 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.503 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 63.8 m -51.25 159.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 125.002 1.439 . . . . 0.0 113.205 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.642 0 CA-C-O 117.297 -1.835 . . . . 0.0 111.048 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.8 t -74.23 144.77 82.13 Favored Pre-proline 0 N--CA 1.494 1.769 0 CA-C-O 119.003 -0.523 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -59.75 -165.84 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.382 2.055 . . . . 0.0 113.228 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.2 mtt-85 -43.12 125.23 3.56 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.859 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.7 132.79 26.23 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.649 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 6.5 mp 52.99 79.21 0.12 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 124.84 1.338 . . . . 0.0 112.534 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.5 141.88 36.23 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.28 129.09 40.39 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.759 0.662 . . . . 0.0 109.796 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER -138.73 133.63 32.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.003 0.814 . . . . 0.0 111.73 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -85.53 -28.03 25.2 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.212 -1.358 . . . . 0.0 109.712 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -132.78 165.73 23.88 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.314 1.009 . . . . 0.0 110.115 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.4 -56.65 17.91 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.0 p -65.64 1.69 1.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.972 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.86 -46.23 51.28 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.659 0.6 . . . . 0.0 111.703 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.1 m -85.04 -178.21 6.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.026 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 143.76 43.62 Favored 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.832 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.68 103.56 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.154 0.909 . . . . 0.0 111.318 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 142.62 -32.39 1.95 Allowed Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -79.85 166.46 21.67 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.965 0.412 . . . . 0.0 109.974 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.3 m -146.39 147.33 18.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.851 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -104.91 118.26 36.09 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 113.44 -1.709 . . . . 0.0 108.736 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.74 178.42 53.3 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -51.57 -24.06 16.25 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.869 1.712 . . . . 0.0 111.372 170.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -60.68 -18.91 56.81 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.323 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.66 5.1 89.76 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -122.35 143.89 49.36 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.336 0.589 . . . . 0.0 110.134 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 73.2 m -64.4 172.5 2.53 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.159 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.677 0 CA-C-O 116.527 -2.263 . . . . 0.0 110.2 179.768 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.519 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 8.5 t -58.04 -40.99 87.44 Favored Pre-proline 0 N--CA 1.495 1.792 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' A' ' 2' ' ' CYS . 3.0 Cg_endo -70.83 129.99 17.33 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.447 2.098 . . . . 0.0 109.691 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.71 -172.1 2.04 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.263 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.19 -179.26 0.14 Allowed 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.738 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.675 ' HB3' HH21 ' A' ' 8' ' ' ARG . 3.6 mm? -48.83 82.27 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 124.472 1.107 . . . . 0.0 113.559 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 46.2 ttm -98.16 107.83 20.39 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.215 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.675 HH21 ' HB3' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -78.32 150.37 33.29 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.367 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.0 155.22 19.6 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.774 0.797 . . . . 0.0 111.183 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -124.12 -19.56 5.56 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.078 -1.874 . . . . 0.0 107.413 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -150.86 154.27 36.9 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -53.81 -44.3 70.08 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.141 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.8 p -79.2 22.46 0.41 Allowed 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.443 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -52.68 -36.37 56.93 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -93.34 -173.78 3.33 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.204 0.94 . . . . 0.0 110.821 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD12 ' A' ' 16' ' ' LEU . 5.1 mp -57.3 147.43 25.62 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.712 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.21 108.02 0.17 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.695 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.57 -32.78 2.35 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.2 m -81.11 165.18 21.84 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.012 -0.594 . . . . 0.0 110.057 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.55 154.39 12.39 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.269 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -84.34 140.56 31.51 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.89 168.21 24.63 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -52.77 -28.7 39.3 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 122.1 1.867 . . . . 0.0 111.743 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p30 -60.4 -15.72 28.9 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.815 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.58 0.09 79.61 Favored Glycine 0 N--CA 1.481 1.654 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -110.02 163.44 13.57 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -58.41 173.59 0.37 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.874 0.845 . . . . 0.0 111.87 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.45 0 CA-C-O 116.156 -2.469 . . . . 0.0 109.559 179.961 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 52.0 t -126.59 83.1 65.57 Favored Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -62.01 104.7 0.35 Allowed 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 122.147 1.898 . . . . 0.0 110.685 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -169.21 153.71 5.56 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.461 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 mp -57.21 153.16 12.41 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.419 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp -56.34 100.0 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 124.245 0.965 . . . . 0.0 111.204 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.6 ttt -126.04 130.79 51.84 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -72.14 145.44 48.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.473 1.108 . . . . 0.0 110.824 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.73 166.89 10.35 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.558 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -118.6 -26.48 6.15 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 113.403 -1.726 . . . . 0.0 107.21 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.472 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 0.3 OUTLIER -152.34 172.62 16.18 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.827 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.2 -56.91 16.12 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.343 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.7 p -71.77 3.04 4.5 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.4 t70 -48.18 -46.18 34.55 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -78.51 -171.72 2.59 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.6 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 mt -47.9 141.29 5.9 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.92 107.04 0.22 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.614 0.571 . . . . 0.0 110.958 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.58 -21.92 4.19 Favored Glycine 0 N--CA 1.498 2.769 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.236 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.2 m -78.95 173.93 12.05 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.147 0.975 . . . . 0.0 111.532 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.6 m -143.04 170.04 11.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-N 112.765 -2.016 . . . . 0.0 106.564 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 t -114.95 140.38 49.05 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -97.37 160.18 21.26 Favored Glycine 0 CA--C 1.538 1.478 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -52.01 -22.41 14.46 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.919 1.746 . . . . 0.0 112.409 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.41 ' ND2' ' HB2' ' A' ' 26' ' ' PHE . 18.9 p-10 -60.62 -14.82 22.65 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.43 -21.46 46.0 Favored Glycine 0 N--CA 1.48 1.584 0 O-C-N 123.687 0.617 . . . . 0.0 112.117 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.41 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 30.9 m-85 -102.04 168.62 9.27 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 120.776 0.322 . . . . 0.0 110.783 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 72.1 m -50.55 164.61 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 124.547 1.154 . . . . 0.0 111.207 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 -179.538 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.7 t -120.67 100.98 46.31 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 124.215 0.597 . . . . 0.0 110.327 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -67.44 169.16 16.17 Favored 'Trans proline' 0 N--CA 1.487 1.112 0 C-N-CA 121.97 1.78 . . . . 0.0 110.913 165.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.6 73.51 2.6 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.803 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.4 145.94 52.67 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.331 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 79.51 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 O-C-N 124.424 1.077 . . . . 0.0 111.594 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.49 129.04 12.23 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.206 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.19 146.24 39.27 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 124.758 1.286 . . . . 0.0 110.754 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 4.2 p -139.42 -172.8 3.44 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.097 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -158.74 -13.79 0.07 Allowed 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.592 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -131.5 159.72 37.3 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.84 -65.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 82.5 p -72.05 9.13 1.02 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.135 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -50.2 -48.92 54.04 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 123.674 0.609 . . . . 0.0 111.28 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 3.9 m -86.21 -166.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 114.053 -1.431 . . . . 0.0 111.669 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' H ' HD12 ' A' ' 16' ' ' LEU . 2.4 mp -50.78 134.95 24.6 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.047 0.842 . . . . 0.0 111.91 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.81 109.04 0.21 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 123.659 0.6 . . . . 0.0 112.086 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 131.54 -30.08 3.33 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 25.5 m -81.53 161.51 23.56 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.471 0.653 . . . . 0.0 110.595 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.3 m -132.92 161.88 40.9 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 CA-C-N 113.91 -1.496 . . . . 0.0 108.004 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 t -105.59 119.34 38.87 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.92 172.98 48.53 Favored Glycine 0 N--CA 1.481 1.674 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.76 -20.18 42.02 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.748 1.632 . . . . 0.0 111.099 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.509 HD22 ' HB2' ' A' ' 26' ' ' PHE . 7.8 p-10 -66.09 -10.29 39.11 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.183 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.18 -7.53 67.05 Favored Glycine 0 N--CA 1.483 1.781 0 CA-C-O 119.903 -0.387 . . . . 0.0 114.006 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HB2' HD22 ' A' ' 24' ' ' ASN . 5.5 m-85 -115.1 161.11 18.83 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.466 0.65 . . . . 0.0 110.687 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -68.24 143.31 55.33 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.473 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 115.9 -2.611 . . . . 0.0 107.594 179.628 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.329 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.7 t -71.81 124.74 91.34 Favored Pre-proline 0 N--CA 1.497 1.909 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.307 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -66.98 -166.43 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 122.507 2.138 . . . . 0.0 111.959 173.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.581 ' C ' HD22 ' A' ' 5' ' ' LEU . 26.3 tpt180 -163.91 81.35 0.43 Allowed 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 114.667 -1.151 . . . . 0.0 107.96 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.581 HD22 ' C ' ' A' ' 4' ' ' ARG . 4.0 mm? -128.11 135.56 49.96 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 113.571 -1.65 . . . . 0.0 107.868 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.83 93.8 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 O-C-N 124.204 0.94 . . . . 0.0 111.062 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 42.1 mtt -137.9 132.19 32.08 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.593 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -72.63 146.98 46.23 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.122 0.889 . . . . 0.0 111.255 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.8 p -141.68 162.13 36.24 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.108 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -131.19 -6.55 3.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 113.65 -1.614 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 10.2 mm-40 -133.96 153.28 51.88 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.982 0.801 . . . . 0.0 110.876 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.19 -61.1 2.8 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.4 p -69.09 4.46 1.58 Allowed 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.992 -1.458 . . . . 0.0 112.849 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 22.3 t0 -53.36 -45.44 69.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.519 0.512 . . . . 0.0 110.636 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.2 -174.67 5.18 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 124.188 0.93 . . . . 0.0 110.059 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.31 162.82 21.96 Favored 'General case' 0 N--CA 1.499 2.02 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.95 124.37 8.59 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.118 -1.401 . . . . 0.0 112.262 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.34 -24.8 21.72 Favored Glycine 0 N--CA 1.495 2.621 0 O-C-N 124.574 1.171 . . . . 0.0 112.226 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.3 m -86.37 170.43 12.02 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.718 0.77 . . . . 0.0 112.075 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -146.47 161.13 10.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.493 -1.685 . . . . 0.0 106.52 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.94 101.27 8.52 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.838 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.425 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -53.29 115.23 4.46 Favored Glycine 0 N--CA 1.491 2.314 0 CA-C-O 118.374 -1.237 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -59.53 87.88 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.182 0 C-N-CA 122.833 2.355 . . . . 0.0 110.835 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -177.67 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 112.13 -2.304 . . . . 0.0 107.94 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 152.94 -49.31 0.52 Allowed Glycine 0 N--CA 1.482 1.753 0 O-C-N 124.094 0.871 . . . . 0.0 111.933 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -95.67 161.14 14.16 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.469 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 92.8 m -63.6 165.17 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.557 1.161 . . . . 0.0 110.564 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.018 -1.99 . . . . 0.0 110.456 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.591 ' SG ' HD21 ' A' ' 5' ' ' LEU . 42.2 t -71.94 130.55 86.58 Favored Pre-proline 0 N--CA 1.495 1.816 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.158 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.27 -179.56 0.64 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.277 1.984 . . . . 0.0 112.947 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 119.75 3.57 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.591 HD21 ' SG ' ' A' ' 2' ' ' CYS . 25.0 mt -89.25 111.67 22.54 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.12 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -179.62 41.03 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 124.089 0.868 . . . . 0.0 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.66 143.52 33.65 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.703 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -65.77 145.08 56.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 124.653 1.22 . . . . 0.0 110.697 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.5 p -124.67 119.46 29.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.067 0.854 . . . . 0.0 112.769 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.11 -20.72 26.67 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.068 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -136.25 161.86 34.6 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.301 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.23 -49.73 75.93 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -78.42 16.8 0.74 Allowed 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.163 -1.835 . . . . 0.0 113.272 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.7 -49.26 73.45 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.316 0.385 . . . . 0.0 110.794 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -81.62 -176.28 5.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.087 0.867 . . . . 0.0 110.303 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.96 151.58 21.6 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.56 111.0 0.57 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.557 -1.201 . . . . 0.0 110.724 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.13 -30.97 2.75 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -83.41 178.15 8.16 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 121.422 0.629 . . . . 0.0 110.885 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -151.43 166.08 2.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-N 114.091 -1.413 . . . . 0.0 107.332 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.36 105.14 17.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.67 0.606 . . . . 0.0 109.562 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.16 146.56 44.65 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -51.2 -24.73 15.75 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.305 2.003 . . . . 0.0 112.865 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.57 -19.23 14.82 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 111.77 -25.6 12.92 Favored Glycine 0 N--CA 1.482 1.745 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.05 164.98 11.34 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.196 -0.502 . . . . 0.0 109.661 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.8 m -63.01 158.62 18.97 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 CA-C-O 116.174 -2.459 . . . . 0.0 107.696 -179.828 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.42 133.51 95.39 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.953 -0.546 . . . . 0.0 110.808 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -63.13 151.21 85.94 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.135 1.89 . . . . 0.0 111.979 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 139.3 50.79 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.766 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -170.47 112.47 0.42 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 124.108 0.88 . . . . 0.0 109.936 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.61 91.49 0.8 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.82 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.9 mtt -142.41 129.18 20.49 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.601 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 30.0 mtm-85 -70.4 132.01 44.96 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.849 1.343 . . . . 0.0 109.986 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.73 177.67 4.78 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.874 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -136.55 -11.62 1.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.942 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -156.89 166.84 32.23 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -52.96 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -79.36 18.09 0.75 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.917 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -53.77 -38.84 64.86 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.485 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 m -79.48 -166.22 0.93 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.737 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -48.65 141.1 7.49 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.71 0.631 . . . . 0.0 112.543 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.5 107.84 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.001 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.47 -23.51 4.53 Favored Glycine 0 N--CA 1.497 2.758 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -79.6 160.03 26.57 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 122.063 0.935 . . . . 0.0 112.919 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.4 m -130.79 159.93 42.41 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 CA-C-N 112.751 -2.022 . . . . 0.0 106.089 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -119.7 87.9 2.83 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.09 176.43 3.65 Favored Glycine 0 N--CA 1.49 2.273 0 CA-C-N 115.685 -0.688 . . . . 0.0 113.322 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.54 86.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.884 2.389 . . . . 0.0 110.103 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 p30 179.65 -25.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 112.938 -1.937 . . . . 0.0 109.188 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.23 19.93 76.12 Favored Glycine 0 N--CA 1.487 2.069 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.832 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.404 ' CZ ' ' HG3' ' A' ' 8' ' ' ARG . 10.4 m-85 -124.85 147.55 48.7 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -61.65 136.4 57.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.153 -1.019 . . . . 0.0 108.679 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 116.115 -2.492 . . . . 0.0 108.335 -179.847 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.523 ' SG ' HD21 ' A' ' 5' ' ' LEU . 42.8 t -80.82 132.13 58.4 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.778 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -65.72 -169.68 0.16 Allowed 'Trans proline' 0 N--CA 1.492 1.428 0 C-N-CA 122.219 1.946 . . . . 0.0 111.403 170.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -59.39 137.22 58.07 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.523 HD21 ' SG ' ' A' ' 2' ' ' CYS . 4.3 mm? -93.57 160.14 14.92 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.049 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -175.82 37.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.75 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 82.9 mtp -142.35 149.92 40.06 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.179 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -66.57 151.3 47.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.231 0.957 . . . . 0.0 110.401 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.4 t -100.08 172.03 7.45 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.015 0.912 . . . . 0.0 112.55 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -160.5 13.39 0.11 Allowed 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 113.077 -1.874 . . . . 0.0 108.252 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 140.07 169.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 126.867 2.067 . . . . 0.0 108.907 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.81 -55.46 26.37 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.552 0.691 . . . . 0.0 109.444 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.4 p -62.11 -14.2 34.36 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 113.817 -1.538 . . . . 0.0 114.43 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -50.82 -49.2 59.21 Favored 'General case' 0 N--CA 1.503 2.18 0 CA-C-O 121.886 0.85 . . . . 0.0 111.339 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -79.6 -170.85 2.53 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.858 -1.974 . . . . 0.0 109.538 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.65 141.07 53.69 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.32 103.54 0.05 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 123.836 0.71 . . . . 0.0 110.803 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.83 -31.64 1.61 Allowed Glycine 0 N--CA 1.496 2.652 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.1 m -79.97 -169.84 2.19 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.1 m -145.74 179.58 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -99.63 94.9 6.61 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.383 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.07 109.62 2.55 Favored Glycine 0 N--CA 1.489 2.169 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.089 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -50.3 -27.01 16.85 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.641 2.227 . . . . 0.0 113.908 -165.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -52.05 -32.75 35.89 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.863 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.82 -33.62 1.27 Allowed Glycine 0 N--CA 1.485 1.955 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -101.06 174.65 5.9 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.932 -0.634 . . . . 0.0 109.563 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 65.0 m -61.01 179.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.304 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.832 0 CA-C-O 116.451 -2.305 . . . . 0.0 113.659 -179.879 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 15' ' ' CYS . 9.1 t -145.93 75.57 12.96 Favored Pre-proline 0 N--CA 1.495 1.797 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -67.36 137.69 44.12 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 121.893 1.728 . . . . 0.0 109.862 174.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.35 114.8 0.67 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.52 1.138 . . . . 0.0 112.395 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tp -171.22 159.64 5.93 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.46 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 6' ' ' LEU . 7.2 mp -84.06 47.93 1.39 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.069 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 ptp -77.09 130.02 36.83 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.81 131.39 50.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.996 0.81 . . . . 0.0 111.902 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -93.16 -159.4 0.68 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.754 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 -18.37 0.09 Allowed 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 113.975 -1.466 . . . . 0.0 108.592 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.42 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 10.8 mt-30 -160.45 168.4 25.21 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -58.07 -62.78 1.57 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.841 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.9 p -77.02 24.56 0.16 Allowed 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.413 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 4.4 t70 -48.72 -52.83 21.51 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.433 ' HB3' ' SG ' ' A' ' 2' ' ' CYS . 89.4 m -80.78 -178.88 7.01 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-N 113.757 -1.565 . . . . 0.0 112.321 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -53.49 146.08 13.48 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.27 102.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.875 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 144.29 -34.0 1.66 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 108.731 -1.748 . . . . 0.0 108.731 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.5 m -86.31 163.14 17.87 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 114.948 -0.626 . . . . 0.0 109.328 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.1 155.11 6.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.705 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.8 t -98.02 128.08 44.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.65 1.219 . . . . 0.0 109.639 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -91.51 178.41 41.3 Favored Glycine 0 N--CA 1.479 1.547 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -53.26 -26.42 34.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.968 1.779 . . . . 0.0 110.734 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -59.88 -14.93 17.58 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.25 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.49 -13.0 54.03 Favored Glycine 0 N--CA 1.481 1.638 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -101.16 153.53 19.51 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.242 0.544 . . . . 0.0 111.584 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.41 178.31 2.98 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.549 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.801 0 CA-C-O 114.96 -3.133 . . . . 0.0 114.414 179.784 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 t -119.37 93.31 47.05 Favored Pre-proline 0 N--CA 1.496 1.854 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.42 119.7 6.91 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 C-N-CA 121.581 1.521 . . . . 0.0 110.9 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -51.85 142.95 14.2 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.672 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.39 133.36 1.71 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 tt -58.35 96.59 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 124.252 0.97 . . . . 0.0 109.812 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.3 mmm -140.59 115.91 9.98 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.294 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.79 143.98 57.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 124.162 0.914 . . . . 0.0 108.877 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -118.07 -161.23 0.82 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.217 0.948 . . . . 0.0 111.581 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 -23.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.516 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.451 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 57.4 mt-30 -148.6 167.08 26.4 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.077 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.61 -54.07 45.05 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -74.73 8.42 2.42 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.771 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.451 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 7.0 t70 -48.76 -49.02 40.4 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 123.664 0.603 . . . . 0.0 111.584 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.5 m -84.54 -179.53 7.17 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.764 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.22 145.82 7.5 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.68 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.07 -30.21 2.85 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 109.349 -1.501 . . . . 0.0 109.349 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 80.3 m -79.89 152.87 29.38 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.155 0.502 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -136.19 150.0 27.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.504 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -119.61 120.73 37.53 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.378 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.29 178.82 53.79 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -49.93 -24.54 10.65 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 121.941 1.761 . . . . 0.0 111.795 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -57.93 -19.54 30.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.276 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.86 18.11 77.56 Favored Glycine 0 N--CA 1.486 1.973 0 O-C-N 123.492 0.495 . . . . 0.0 113.583 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -127.28 142.57 51.43 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 54.0 m -71.17 170.35 13.17 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 124.509 1.131 . . . . 0.0 110.892 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.72 0 CA-C-O 117.285 -1.842 . . . . 0.0 109.581 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.14 126.66 91.76 Favored Pre-proline 0 N--CA 1.497 1.905 0 CA-C-N 114.844 -0.678 . . . . 0.0 110.635 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -64.28 121.43 9.06 Favored 'Trans proline' 0 N--CA 1.488 1.17 0 C-N-CA 121.849 1.7 . . . . 0.0 110.395 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -57.78 109.4 0.71 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 124.219 0.95 . . . . 0.0 110.562 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.7 124.91 0.47 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.044 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.15 71.49 5.65 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 122.061 0.934 . . . . 0.0 111.483 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.5 mmt -90.72 137.13 32.6 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.328 -1.306 . . . . 0.0 108.232 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.17 137.86 51.33 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 124.42 1.075 . . . . 0.0 109.376 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 2.9 p -137.63 -167.12 2.07 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.21 0.944 . . . . 0.0 111.6 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -159.91 -9.14 0.06 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -143.51 165.86 26.41 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.764 0.665 . . . . 0.0 109.894 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -54.97 -70.01 0.12 Allowed 'General case' 0 N--CA 1.49 1.575 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.908 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.1 p -74.76 11.67 1.0 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.957 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -52.73 -43.43 65.71 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 123.578 0.549 . . . . 0.0 110.696 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.6 m -92.48 -163.11 1.0 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.995 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.68 138.83 58.62 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.514 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.46 105.1 0.08 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 124.255 0.972 . . . . 0.0 111.548 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 143.65 -34.35 1.7 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.28 -1.528 . . . . 0.0 109.28 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -86.71 164.24 16.87 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 124.012 0.477 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.3 m -146.88 147.0 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 O-C-N 124.302 1.001 . . . . 0.0 109.638 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.14 141.36 35.98 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.003 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -140.8 -161.93 8.9 Favored Glycine 0 N--CA 1.483 1.776 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -53.56 -25.89 34.66 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.089 1.859 . . . . 0.0 112.74 -174.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -61.4 -19.38 61.84 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.15 -13.41 20.37 Favored Glycine 0 N--CA 1.482 1.711 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -105.86 155.41 19.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.963 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 58.5 m -60.76 166.94 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.415 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 CA-C-O 116.459 -2.301 . . . . 0.0 109.567 -179.767 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 110.116 -1.193 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.524 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 8.2 t -62.92 -39.98 58.3 Favored Pre-proline 0 N--CA 1.495 1.783 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.524 ' CD ' ' N ' ' A' ' 2' ' ' CYS . 6.0 Cg_exo -68.91 125.04 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 C-N-CA 122.506 2.138 . . . . 0.0 109.085 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -166.94 -170.71 1.61 Allowed 'General case' 0 N--CA 1.485 1.318 0 O-C-N 124.555 1.159 . . . . 0.0 109.791 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 pp -59.56 -173.82 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.955 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.3 mt -54.92 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.895 0.747 . . . . 0.0 112.228 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 77.4 mtp -101.88 94.74 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 114.422 -1.263 . . . . 0.0 107.958 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.17 147.87 42.21 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.02 0.825 . . . . 0.0 109.354 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.56 163.24 30.17 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.964 0.887 . . . . 0.0 112.517 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.11 -15.5 8.71 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.611 -2.086 . . . . 0.0 108.653 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -139.98 153.33 46.85 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-O 121.234 0.54 . . . . 0.0 111.066 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.17 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.137 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.2 p -71.56 9.62 0.8 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -51.38 -38.1 51.63 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 123.674 0.609 . . . . 0.0 112.141 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.5 m -79.06 -163.53 0.5 Allowed 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.174 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.95 141.23 18.26 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 123.843 0.715 . . . . 0.0 110.735 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.96 102.55 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.669 0.605 . . . . 0.0 112.309 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.61 -21.95 3.96 Favored Glycine 0 N--CA 1.498 2.794 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.811 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 5.6 m -79.28 172.95 13.09 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.26 1.028 . . . . 0.0 112.385 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.75 178.54 4.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-N 112.574 -2.103 . . . . 0.0 106.96 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.23 135.45 54.98 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.53 159.26 36.54 Favored Glycine 0 N--CA 1.481 1.634 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.229 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -51.9 -28.05 30.01 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 C-N-CA 122.09 1.86 . . . . 0.0 111.719 177.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 p30 -63.7 -9.15 12.65 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.96 -2.67 79.94 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 114.956 0.742 . . . . 0.0 114.956 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -113.36 162.69 15.77 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.29 0.567 . . . . 0.0 110.75 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.9 m -57.53 165.23 1.64 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.633 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 CA-C-O 116.516 -2.269 . . . . 0.0 110.552 179.947 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.372 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.9 t -70.03 132.84 88.17 Favored Pre-proline 0 N--CA 1.497 1.903 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.79 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -64.28 148.39 91.04 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 121.935 1.757 . . . . 0.0 110.416 169.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.97 86.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.792 1.307 . . . . 0.0 114.216 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 112.09 8.78 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.845 -1.071 . . . . 0.0 108.123 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -80.06 60.68 3.67 Favored 'General case' 0 N--CA 1.482 1.16 0 O-C-N 124.312 1.008 . . . . 0.0 110.819 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 32.5 mtp -143.7 142.74 31.11 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.502 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.74 139.02 36.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.587 1.179 . . . . 0.0 109.114 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 1.8 p -129.83 -173.85 3.15 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.379 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -139.72 -37.42 0.49 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.748 -1.114 . . . . 0.0 108.732 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.428 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 6.8 mm100 -122.38 168.36 12.17 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.909 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.452 ' OD2' HG12 ' A' ' 20' ' ' VAL . 12.4 t70 -57.43 -67.66 0.31 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 p -61.95 -1.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 114.437 -1.256 . . . . 0.0 113.801 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.428 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.1 t70 -53.43 -41.41 66.04 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.7 m -92.76 -164.06 1.13 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 113.92 -1.491 . . . . 0.0 109.079 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.7 tt -57.83 133.78 55.71 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.174 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.91 110.04 0.23 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.746 0.654 . . . . 0.0 112.508 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.29 -27.35 4.79 Favored Glycine 0 N--CA 1.495 2.593 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.522 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 m -78.83 149.77 32.45 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.431 0.634 . . . . 0.0 111.66 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.452 HG12 ' OD2' ' A' ' 12' ' ' ASP . 35.1 m -111.35 153.69 13.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 CA-C-N 113.517 -1.674 . . . . 0.0 108.402 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 t -112.57 90.87 3.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 124.475 1.109 . . . . 0.0 109.523 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.59 170.56 27.28 Favored Glycine 0 N--CA 1.488 2.155 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.612 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -51.4 -26.62 21.74 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 C-N-CA 122.265 1.977 . . . . 0.0 113.132 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -57.03 -21.7 33.12 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.71 -19.8 48.93 Favored Glycine 0 N--CA 1.477 1.412 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -98.56 144.43 27.88 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 123.663 0.272 . . . . 0.0 110.282 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.3 144.89 55.64 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.946 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.919 0 CA-C-O 115.702 -2.721 . . . . 0.0 113.368 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.391 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t -147.08 85.42 6.93 Favored Pre-proline 0 N--CA 1.493 1.699 0 O-C-N 124.125 0.544 . . . . 0.0 109.835 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -64.35 125.22 14.65 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 121.986 1.791 . . . . 0.0 110.884 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.13 138.98 48.78 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.306 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.8 tp -168.61 148.85 4.54 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.581 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.52 95.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.485 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 40.7 ttm -160.2 105.3 1.51 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.299 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.493 HH21 ' H ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -65.69 139.87 58.42 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.835 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.5 p -100.95 128.96 46.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 ptmt -93.75 -20.19 20.35 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.95 157.75 42.2 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 114.476 -1.238 . . . . 0.0 107.795 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -54.19 -68.53 0.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.021 0.438 . . . . 0.0 111.13 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.4 p -73.33 17.67 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.756 -1.111 . . . . 0.0 113.733 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -53.3 -46.78 69.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.488 0.492 . . . . 0.0 111.688 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -79.31 -177.16 5.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.679 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.05 152.28 0.56 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.94 108.07 0.32 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.871 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.88 -22.86 4.01 Favored Glycine 0 N--CA 1.495 2.6 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.558 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.4 m -79.53 152.14 30.33 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.155 0.979 . . . . 0.0 112.767 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.4 m -144.02 151.39 16.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-N 112.539 -2.119 . . . . 0.0 105.905 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.9 t -101.66 100.56 10.96 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.306 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.31 -175.43 21.88 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -54.09 -13.97 5.51 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 122.093 1.862 . . . . 0.0 113.054 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -64.72 -20.5 66.37 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.68 -15.81 39.7 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.63 169.07 8.67 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.1 m -62.2 165.84 5.43 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.6 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.245 -179.675 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.373 0 N-CA-C 110.684 -0.966 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.21 135.3 79.68 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-N 115.114 -0.543 . . . . 0.0 110.376 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -66.4 139.68 55.16 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 121.96 1.773 . . . . 0.0 110.491 170.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.84 49.52 0.78 Allowed 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.39 107.07 0.52 Allowed 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.55 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.6 tt -62.96 93.37 0.06 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.3 ttp -140.92 143.14 34.43 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.173 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 142.43 58.4 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.357 1.036 . . . . 0.0 110.335 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' SG ' ' C ' ' A' ' 26' ' ' PHE . 31.3 p -155.89 175.06 14.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.796 0.685 . . . . 0.0 111.522 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -146.76 -11.04 0.45 Allowed 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -141.07 160.89 39.12 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 123.777 0.673 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.17 -64.3 0.88 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.8 p -61.79 -10.41 8.93 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.153 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.64 -46.26 58.27 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.68 0.613 . . . . 0.0 110.812 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.4 m -91.38 -166.11 1.5 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.156 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.53 141.19 32.16 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 123.715 0.634 . . . . 0.0 112.268 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 107.18 0.2 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.967 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.45 -20.58 5.82 Favored Glycine 0 N--CA 1.499 2.872 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.631 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.2 m -79.65 167.99 19.95 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.443 0.64 . . . . 0.0 112.398 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.6 m -130.16 157.92 42.65 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.75 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.1 t -114.0 87.84 2.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.987 0.804 . . . . 0.0 108.938 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.8 173.6 4.64 Favored Glycine 0 N--CA 1.49 2.299 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.414 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -53.72 -23.78 27.67 Favored 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 122.468 2.112 . . . . 0.0 113.19 -175.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -60.15 -14.28 16.39 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.73 9.44 87.06 Favored Glycine 0 N--CA 1.483 1.775 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.41 ' C ' ' SG ' ' A' ' 9' ' ' CYS . 7.4 m-85 -126.99 155.48 43.13 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.9 m -60.1 147.58 38.96 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.653 0.739 . . . . 0.0 110.639 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.416 0 CA-C-O 117.038 -1.979 . . . . 0.0 109.204 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 111.466 -0.654 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.1 t -123.59 84.5 53.2 Favored Pre-proline 0 N--CA 1.493 1.677 0 CA-C-N 114.027 -1.087 . . . . 0.0 109.353 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -60.77 145.8 98.37 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.474 2.116 . . . . 0.0 112.688 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.29 124.82 21.45 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.885 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.41 -172.9 0.18 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 124.304 1.002 . . . . 0.0 108.783 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.84 123.58 14.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 123.476 0.485 . . . . 0.0 109.825 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.4 mtt -86.27 49.77 1.86 Allowed 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.793 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -106.21 127.76 53.46 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.521 ' SG ' ' N ' ' A' ' 10' ' ' LYS . 0.5 OUTLIER -120.97 -161.02 0.87 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 123.956 0.785 . . . . 0.0 111.239 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.521 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 1.6 tptm -152.84 -26.32 0.15 Allowed 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.984 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.423 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 mp0 -150.69 171.62 16.87 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -50.12 -75.16 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -78.68 18.14 0.62 Allowed 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.718 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 30.9 t70 -56.48 -36.2 68.83 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.618 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.4 m -79.15 -168.75 1.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.819 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.81 146.84 35.67 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.259 0.836 . . . . 0.0 113.259 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.57 104.34 0.06 Allowed 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.401 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.34 -30.7 2.5 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 2.8 m -82.87 157.48 23.08 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 122.184 0.993 . . . . 0.0 112.466 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.0 m -133.65 160.14 42.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 104.171 -2.529 . . . . 0.0 104.171 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.0 t -121.5 140.61 51.97 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.941 -0.704 . . . . 0.0 112.764 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.92 174.32 47.71 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 113.934 -1.485 . . . . 0.0 110.141 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -52.92 -30.42 48.08 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.091 1.861 . . . . 0.0 110.651 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -61.35 -9.55 5.53 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 113.662 -1.608 . . . . 0.0 114.196 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.18 17.79 76.1 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 111.9 -0.48 . . . . 0.0 111.9 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -117.19 144.0 45.24 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.967 -0.617 . . . . 0.0 109.794 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.0 m -74.12 146.74 43.31 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 124.311 1.007 . . . . 0.0 112.628 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 115.937 -2.59 . . . . 0.0 109.702 179.714 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 49.0 t -72.45 131.79 84.41 Favored Pre-proline 0 N--CA 1.496 1.83 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.397 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -67.0 137.57 44.98 Favored 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.722 1.615 . . . . 0.0 110.567 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -53.59 120.62 6.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 123.951 0.782 . . . . 0.0 112.862 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.4 tt -172.86 87.09 0.07 Allowed 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.47 95.27 1.36 Allowed 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.92 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.3 ptm -131.86 158.53 41.1 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.749 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.59 142.88 42.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.003 0.815 . . . . 0.0 108.964 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . 2.1 p -123.79 128.59 49.76 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 124.252 0.97 . . . . 0.0 112.128 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -82.71 -32.32 28.07 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.862 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -138.44 170.57 15.79 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.316 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -57.74 -60.48 3.63 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.023 0.44 . . . . 0.0 111.388 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.2 p -68.36 6.97 0.67 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.63 -45.85 63.43 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 123.47 0.481 . . . . 0.0 111.385 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -81.68 -177.14 6.42 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.487 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.92 147.46 12.19 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.044 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.34 106.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.647 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.85 -26.6 2.87 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.8 m -84.92 172.44 11.37 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.118 0.961 . . . . 0.0 111.973 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 m -141.67 165.92 17.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.887 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 t -92.98 108.91 20.37 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.207 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.16 115.86 6.18 Favored Glycine 0 N--CA 1.49 2.239 0 CA-C-O 118.23 -1.317 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.33 85.78 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 123.038 2.492 . . . . 0.0 112.19 -173.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.3 p30 177.98 -35.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.11 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.84 -42.71 0.62 Allowed Glycine 0 N--CA 1.482 1.75 0 O-C-N 123.986 0.804 . . . . 0.0 112.982 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -92.97 149.98 20.86 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.484 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 2.3 m -63.82 172.42 2.24 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 124.844 1.34 . . . . 0.0 113.019 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.469 0 CA-C-O 115.881 -2.621 . . . . 0.0 110.829 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.419 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 t -93.24 118.97 67.84 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 114.919 -0.641 . . . . 0.0 110.2 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.31 173.08 10.14 Favored 'Trans proline' 0 N--CA 1.487 1.136 0 C-N-CA 122.123 1.882 . . . . 0.0 110.541 171.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -42.12 148.84 0.17 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.31 109.97 1.55 Allowed 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.882 -1.053 . . . . 0.0 108.859 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.56 72.5 4.1 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 124.275 0.985 . . . . 0.0 109.929 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 57.1 mtp -138.54 139.32 38.65 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.35 133.91 51.48 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 123.817 0.698 . . . . 0.0 112.604 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.58 177.9 4.65 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.967 -1.47 . . . . 0.0 109.645 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -149.8 -26.78 0.26 Allowed 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.098 -1.41 . . . . 0.0 108.205 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -155.17 167.29 30.84 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.01 -67.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.019 0.438 . . . . 0.0 110.001 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.0 p -67.36 -3.16 7.42 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.808 -1.087 . . . . 0.0 113.286 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -52.21 -38.63 58.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 123.515 0.509 . . . . 0.0 112.128 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.6 m -97.27 -164.63 1.17 Allowed 'General case' 0 N--CA 1.484 1.272 0 O-C-N 124.651 1.219 . . . . 0.0 111.091 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.3 142.16 10.55 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 124.02 0.825 . . . . 0.0 111.684 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.1 113.03 0.98 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.871 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.28 -21.64 9.24 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.163 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -79.92 162.95 24.68 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 120.563 0.22 . . . . 0.0 110.971 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.8 m -134.76 154.78 37.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 O-C-N 124.312 1.008 . . . . 0.0 110.066 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.5 t -90.35 107.11 18.94 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.747 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.31 170.22 54.49 Favored Glycine 0 N--CA 1.484 1.86 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.927 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.98 -36.26 99.18 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.416 2.078 . . . . 0.0 111.22 177.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -65.99 -1.55 3.17 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.843 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.44 13.85 82.51 Favored Glycine 0 N--CA 1.482 1.711 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.951 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -110.35 149.24 30.5 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.178 0.513 . . . . 0.0 111.605 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.0 m -62.54 165.96 5.74 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.153 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.84 0 CA-C-O 117.669 -1.629 . . . . 0.0 112.868 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.4 t -139.89 91.06 10.54 Favored Pre-proline 0 N--CA 1.491 1.599 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.246 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -64.09 -176.03 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.577 2.185 . . . . 0.0 113.235 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -48.1 119.42 2.9 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.106 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.501 HD13 ' H ' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -70.85 132.86 45.91 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.303 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.501 ' H ' HD13 ' A' ' 5' ' ' LEU . 0.5 OUTLIER 179.01 44.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.378 -1.283 . . . . 0.0 108.127 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.75 139.64 27.99 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.48 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.01 147.46 32.87 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.176 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.2 p -138.0 141.6 40.44 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.8 18.02 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.126 -1.397 . . . . 0.0 109.186 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -139.52 174.51 10.44 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.754 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.68 -53.11 61.35 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.282 0.563 . . . . 0.0 109.749 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 p -57.49 -11.83 2.24 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.182 -1.372 . . . . 0.0 114.184 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -49.0 -47.14 44.59 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 123.894 0.746 . . . . 0.0 112.223 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.5 m -90.82 177.91 6.19 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.487 1.117 . . . . 0.0 110.338 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.5 155.44 40.58 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.921 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.63 112.31 0.58 Allowed 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 134.7 -34.59 2.32 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -90.6 155.49 18.82 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.719 0.771 . . . . 0.0 111.235 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.1 m -128.96 167.65 23.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 CA-C-N 113.222 -1.808 . . . . 0.0 107.506 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 t -111.19 111.68 22.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 123.674 0.609 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.73 147.81 26.91 Favored Glycine 0 CA--C 1.541 1.705 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -52.45 -21.49 14.06 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.315 2.01 . . . . 0.0 113.145 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.416 ' H ' HD22 ' A' ' 24' ' ' ASN . 1.6 p30 -56.43 -27.08 55.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 124.132 0.895 . . . . 0.0 113.26 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 122.54 -38.96 2.4 Favored Glycine 0 N--CA 1.481 1.676 0 O-C-N 123.947 0.779 . . . . 0.0 111.205 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -93.59 158.08 15.87 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 115.233 -0.484 . . . . 0.0 111.301 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.422 ' HB2' HD11 ' A' ' 5' ' ' LEU . 1.7 m -68.89 178.28 2.25 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.747 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 179.833 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 24.3 mmm . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.81 138.05 58.15 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 124.579 1.174 . . . . 0.0 111.837 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -126.46 163.8 22.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 124.319 1.012 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -138.69 -20.97 1.01 Allowed 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.288 -1.778 . . . . 0.0 108.393 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -145.34 163.25 35.13 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.388 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -57.31 -57.65 11.69 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.527 0.68 . . . . 0.0 109.948 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.3 p -54.63 -13.12 0.89 Allowed 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 113.879 -1.51 . . . . 0.0 114.458 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -47.12 -45.72 22.49 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.029 0.831 . . . . 0.0 112.113 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.2 m -89.57 -169.69 2.57 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.991 -1.913 . . . . 0.0 111.471 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mt -75.78 144.97 41.09 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.549 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.03 106.92 0.1 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 124.238 0.962 . . . . 0.0 111.24 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.77 -35.33 1.79 Allowed Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 3.8 m -89.02 172.13 9.34 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.742 0.782 . . . . 0.0 111.301 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.2 m -135.6 167.23 25.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 CA-C-N 113.293 -1.776 . . . . 0.0 107.028 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 t -74.96 98.11 3.51 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.238 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.503 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -49.2 112.06 1.19 Allowed Glycine 0 N--CA 1.494 2.5 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.39 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo -62.19 85.99 0.1 Allowed 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 123.321 2.681 . . . . 0.0 110.675 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.401 HD22 ' H ' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -179.76 -35.58 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.198 -179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.08 -53.46 0.4 Allowed Glycine 0 N--CA 1.48 1.619 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.401 ' H ' HD22 ' A' ' 24' ' ' ASN . 5.7 m-85 -96.96 162.21 13.49 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.114 -0.543 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.503 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 63.8 m -51.25 159.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 125.002 1.439 . . . . 0.0 113.205 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.642 0 CA-C-O 117.297 -1.835 . . . . 0.0 111.048 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.967 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.28 129.09 40.39 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.759 0.662 . . . . 0.0 109.796 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER -138.73 133.63 32.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.003 0.814 . . . . 0.0 111.73 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -85.53 -28.03 25.2 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.212 -1.358 . . . . 0.0 109.712 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -132.78 165.73 23.88 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.314 1.009 . . . . 0.0 110.115 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.4 -56.65 17.91 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.0 p -65.64 1.69 1.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.972 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.86 -46.23 51.28 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.659 0.6 . . . . 0.0 111.703 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.1 m -85.04 -178.21 6.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.026 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 143.76 43.62 Favored 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.832 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.68 103.56 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.154 0.909 . . . . 0.0 111.318 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 142.62 -32.39 1.95 Allowed Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -79.85 166.46 21.67 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.965 0.412 . . . . 0.0 109.974 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.3 m -146.39 147.33 18.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.851 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -104.91 118.26 36.09 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 113.44 -1.709 . . . . 0.0 108.736 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.74 178.42 53.3 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -51.57 -24.06 16.25 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.869 1.712 . . . . 0.0 111.372 170.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -60.68 -18.91 56.81 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.323 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.66 5.1 89.76 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -122.35 143.89 49.36 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.336 0.589 . . . . 0.0 110.134 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 73.2 m -64.4 172.5 2.53 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.159 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.677 0 CA-C-O 116.527 -2.263 . . . . 0.0 110.2 179.768 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 46.2 ttm . . . . . 0 N--CA 1.497 1.907 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.32 150.37 33.29 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.367 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.0 155.22 19.6 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.774 0.797 . . . . 0.0 111.183 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -124.12 -19.56 5.56 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.078 -1.874 . . . . 0.0 107.413 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -150.86 154.27 36.9 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -53.81 -44.3 70.08 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.141 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.8 p -79.2 22.46 0.41 Allowed 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.443 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -52.68 -36.37 56.93 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -93.34 -173.78 3.33 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.204 0.94 . . . . 0.0 110.821 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD12 ' A' ' 16' ' ' LEU . 5.1 mp -57.3 147.43 25.62 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.712 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.21 108.02 0.17 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.695 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.57 -32.78 2.35 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.2 m -81.11 165.18 21.84 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.012 -0.594 . . . . 0.0 110.057 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.55 154.39 12.39 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.269 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -84.34 140.56 31.51 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.89 168.21 24.63 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -52.77 -28.7 39.3 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 122.1 1.867 . . . . 0.0 111.743 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p30 -60.4 -15.72 28.9 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.815 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.58 0.09 79.61 Favored Glycine 0 N--CA 1.481 1.654 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -110.02 163.44 13.57 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -58.41 173.59 0.37 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.874 0.845 . . . . 0.0 111.87 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.45 0 CA-C-O 116.156 -2.469 . . . . 0.0 109.559 179.961 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -72.14 145.44 48.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.473 1.108 . . . . 0.0 110.824 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.73 166.89 10.35 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.558 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -118.6 -26.48 6.15 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 113.403 -1.726 . . . . 0.0 107.21 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.472 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 0.3 OUTLIER -152.34 172.62 16.18 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.827 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.2 -56.91 16.12 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.343 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.7 p -71.77 3.04 4.5 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.4 t70 -48.18 -46.18 34.55 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -78.51 -171.72 2.59 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.6 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 mt -47.9 141.29 5.9 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.92 107.04 0.22 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.614 0.571 . . . . 0.0 110.958 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.58 -21.92 4.19 Favored Glycine 0 N--CA 1.498 2.769 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.236 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.2 m -78.95 173.93 12.05 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.147 0.975 . . . . 0.0 111.532 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.6 m -143.04 170.04 11.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-N 112.765 -2.016 . . . . 0.0 106.564 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 t -114.95 140.38 49.05 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.465 ' C ' HD22 ' A' ' 24' ' ' ASN . . . -97.37 160.18 21.26 Favored Glycine 0 CA--C 1.538 1.478 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -52.01 -22.41 14.46 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.919 1.746 . . . . 0.0 112.409 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.595 ' H ' HD22 ' A' ' 24' ' ' ASN . 0.0 OUTLIER -60.62 -14.82 22.65 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.43 -21.46 46.0 Favored Glycine 0 N--CA 1.48 1.584 0 O-C-N 123.687 0.617 . . . . 0.0 112.117 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -102.04 168.62 9.27 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 120.776 0.322 . . . . 0.0 110.783 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 72.1 m -50.55 164.61 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 124.547 1.154 . . . . 0.0 111.207 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 -179.538 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.19 146.24 39.27 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 124.758 1.286 . . . . 0.0 110.754 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 4.2 p -139.42 -172.8 3.44 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.097 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -158.74 -13.79 0.07 Allowed 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.592 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -131.5 159.72 37.3 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.84 -65.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 82.5 p -72.05 9.13 1.02 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.135 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -50.2 -48.92 54.04 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 123.674 0.609 . . . . 0.0 111.28 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 3.9 m -86.21 -166.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 114.053 -1.431 . . . . 0.0 111.669 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.45 ' H ' HD12 ' A' ' 16' ' ' LEU . 2.4 mp -50.78 134.95 24.6 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.047 0.842 . . . . 0.0 111.91 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.81 109.04 0.21 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 123.659 0.6 . . . . 0.0 112.086 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 131.54 -30.08 3.33 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 25.5 m -81.53 161.51 23.56 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.471 0.653 . . . . 0.0 110.595 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.3 m -132.92 161.88 40.9 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 CA-C-N 113.91 -1.496 . . . . 0.0 108.004 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 t -105.59 119.34 38.87 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.92 172.98 48.53 Favored Glycine 0 N--CA 1.481 1.674 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.76 -20.18 42.02 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.748 1.632 . . . . 0.0 111.099 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.509 HD22 ' HB2' ' A' ' 26' ' ' PHE . 7.8 p-10 -66.09 -10.29 39.11 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.183 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.18 -7.53 67.05 Favored Glycine 0 N--CA 1.483 1.781 0 CA-C-O 119.903 -0.387 . . . . 0.0 114.006 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HB2' HD22 ' A' ' 24' ' ' ASN . 5.5 m-85 -115.1 161.11 18.83 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.466 0.65 . . . . 0.0 110.687 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -68.24 143.31 55.33 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.473 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 115.9 -2.611 . . . . 0.0 107.594 179.628 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 42.1 mtt . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -72.63 146.98 46.23 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.122 0.889 . . . . 0.0 111.255 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.8 p -141.68 162.13 36.24 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.108 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -131.19 -6.55 3.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 113.65 -1.614 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 10.2 mm-40 -133.96 153.28 51.88 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.982 0.801 . . . . 0.0 110.876 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.19 -61.1 2.8 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.4 p -69.09 4.46 1.58 Allowed 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.992 -1.458 . . . . 0.0 112.849 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 22.3 t0 -53.36 -45.44 69.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.519 0.512 . . . . 0.0 110.636 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.2 -174.67 5.18 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 124.188 0.93 . . . . 0.0 110.059 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.31 162.82 21.96 Favored 'General case' 0 N--CA 1.499 2.02 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.95 124.37 8.59 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.118 -1.401 . . . . 0.0 112.262 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.34 -24.8 21.72 Favored Glycine 0 N--CA 1.495 2.621 0 O-C-N 124.574 1.171 . . . . 0.0 112.226 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.3 m -86.37 170.43 12.02 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.718 0.77 . . . . 0.0 112.075 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -146.47 161.13 10.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.493 -1.685 . . . . 0.0 106.52 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.94 101.27 8.52 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.838 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.425 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -53.29 115.23 4.46 Favored Glycine 0 N--CA 1.491 2.314 0 CA-C-O 118.374 -1.237 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -59.53 87.88 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.182 0 C-N-CA 122.833 2.355 . . . . 0.0 110.835 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.496 HD22 ' H ' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -177.67 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 112.13 -2.304 . . . . 0.0 107.94 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 152.94 -49.31 0.52 Allowed Glycine 0 N--CA 1.482 1.753 0 O-C-N 124.094 0.871 . . . . 0.0 111.933 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.496 ' H ' HD22 ' A' ' 24' ' ' ASN . 5.7 m-85 -95.67 161.14 14.16 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.469 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 92.8 m -63.6 165.17 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.557 1.161 . . . . 0.0 110.564 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.018 -1.99 . . . . 0.0 110.456 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.893 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -65.77 145.08 56.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 124.653 1.22 . . . . 0.0 110.697 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.5 p -124.67 119.46 29.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.067 0.854 . . . . 0.0 112.769 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.11 -20.72 26.67 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.068 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -136.25 161.86 34.6 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.301 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.23 -49.73 75.93 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -78.42 16.8 0.74 Allowed 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.163 -1.835 . . . . 0.0 113.272 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.7 -49.26 73.45 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.316 0.385 . . . . 0.0 110.794 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -81.62 -176.28 5.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.087 0.867 . . . . 0.0 110.303 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.96 151.58 21.6 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.56 111.0 0.57 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.557 -1.201 . . . . 0.0 110.724 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.13 -30.97 2.75 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -83.41 178.15 8.16 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 121.422 0.629 . . . . 0.0 110.885 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -151.43 166.08 2.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-N 114.091 -1.413 . . . . 0.0 107.332 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.36 105.14 17.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.67 0.606 . . . . 0.0 109.562 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.16 146.56 44.65 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -51.2 -24.73 15.75 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.305 2.003 . . . . 0.0 112.865 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.57 -19.23 14.82 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 111.77 -25.6 12.92 Favored Glycine 0 N--CA 1.482 1.745 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.05 164.98 11.34 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.196 -0.502 . . . . 0.0 109.661 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.8 m -63.01 158.62 18.97 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 CA-C-O 116.174 -2.459 . . . . 0.0 107.696 -179.828 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.9 mtt . . . . . 0 N--CA 1.496 1.864 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 30.0 mtm-85 -70.4 132.01 44.96 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.849 1.343 . . . . 0.0 109.986 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.73 177.67 4.78 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.874 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -136.55 -11.62 1.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.942 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -156.89 166.84 32.23 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -52.96 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -79.36 18.09 0.75 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.917 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -53.77 -38.84 64.86 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.485 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 m -79.48 -166.22 0.93 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.737 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -48.65 141.1 7.49 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.71 0.631 . . . . 0.0 112.543 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.5 107.84 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.001 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.47 -23.51 4.53 Favored Glycine 0 N--CA 1.497 2.758 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -79.6 160.03 26.57 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 122.063 0.935 . . . . 0.0 112.919 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.4 m -130.79 159.93 42.41 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 CA-C-N 112.751 -2.022 . . . . 0.0 106.089 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -119.7 87.9 2.83 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.09 176.43 3.65 Favored Glycine 0 N--CA 1.49 2.273 0 CA-C-N 115.685 -0.688 . . . . 0.0 113.322 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.54 86.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.884 2.389 . . . . 0.0 110.103 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 p30 179.65 -25.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 112.938 -1.937 . . . . 0.0 109.188 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.23 19.93 76.12 Favored Glycine 0 N--CA 1.487 2.069 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.832 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.404 ' CZ ' ' HG3' ' A' ' 8' ' ' ARG . 10.4 m-85 -124.85 147.55 48.7 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -61.65 136.4 57.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.153 -1.019 . . . . 0.0 108.679 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 116.115 -2.492 . . . . 0.0 108.335 -179.847 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 82.9 mtp . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -66.57 151.3 47.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.231 0.957 . . . . 0.0 110.401 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.4 t -100.08 172.03 7.45 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.015 0.912 . . . . 0.0 112.55 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -160.5 13.39 0.11 Allowed 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 113.077 -1.874 . . . . 0.0 108.252 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 140.07 169.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 126.867 2.067 . . . . 0.0 108.907 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.81 -55.46 26.37 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.552 0.691 . . . . 0.0 109.444 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.4 p -62.11 -14.2 34.36 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 113.817 -1.538 . . . . 0.0 114.43 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -50.82 -49.2 59.21 Favored 'General case' 0 N--CA 1.503 2.18 0 CA-C-O 121.886 0.85 . . . . 0.0 111.339 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -79.6 -170.85 2.53 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.858 -1.974 . . . . 0.0 109.538 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.65 141.07 53.69 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.32 103.54 0.05 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 123.836 0.71 . . . . 0.0 110.803 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.83 -31.64 1.61 Allowed Glycine 0 N--CA 1.496 2.652 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.1 m -79.97 -169.84 2.19 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.1 m -145.74 179.58 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -99.63 94.9 6.61 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.383 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.07 109.62 2.55 Favored Glycine 0 N--CA 1.489 2.169 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.089 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -50.3 -27.01 16.85 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.641 2.227 . . . . 0.0 113.908 -165.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -52.05 -32.75 35.89 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.863 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.82 -33.62 1.27 Allowed Glycine 0 N--CA 1.485 1.955 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -101.06 174.65 5.9 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.932 -0.634 . . . . 0.0 109.563 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 65.0 m -61.01 179.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.304 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.832 0 CA-C-O 116.451 -2.305 . . . . 0.0 113.659 -179.879 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 ptp . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.81 131.39 50.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.996 0.81 . . . . 0.0 111.902 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -93.16 -159.4 0.68 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.754 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 -18.37 0.09 Allowed 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 113.975 -1.466 . . . . 0.0 108.592 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.42 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 10.8 mt-30 -160.45 168.4 25.21 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -58.07 -62.78 1.57 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.841 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.9 p -77.02 24.56 0.16 Allowed 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.413 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 4.4 t70 -48.72 -52.83 21.51 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.78 -178.88 7.01 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-N 113.757 -1.565 . . . . 0.0 112.321 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -53.49 146.08 13.48 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.27 102.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.875 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 144.29 -34.0 1.66 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 108.731 -1.748 . . . . 0.0 108.731 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.5 m -86.31 163.14 17.87 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 114.948 -0.626 . . . . 0.0 109.328 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.1 155.11 6.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.705 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.8 t -98.02 128.08 44.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.65 1.219 . . . . 0.0 109.639 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -91.51 178.41 41.3 Favored Glycine 0 N--CA 1.479 1.547 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -53.26 -26.42 34.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.968 1.779 . . . . 0.0 110.734 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -59.88 -14.93 17.58 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.25 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.49 -13.0 54.03 Favored Glycine 0 N--CA 1.481 1.638 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -101.16 153.53 19.51 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.242 0.544 . . . . 0.0 111.584 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.41 178.31 2.98 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.549 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.801 0 CA-C-O 114.96 -3.133 . . . . 0.0 114.414 179.784 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.3 mmm . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.79 143.98 57.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 124.162 0.914 . . . . 0.0 108.877 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -118.07 -161.23 0.82 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.217 0.948 . . . . 0.0 111.581 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 -23.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.516 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.451 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 57.4 mt-30 -148.6 167.08 26.4 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.077 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.61 -54.07 45.05 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -74.73 8.42 2.42 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.771 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.451 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 7.0 t70 -48.76 -49.02 40.4 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 123.664 0.603 . . . . 0.0 111.584 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.5 m -84.54 -179.53 7.17 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.764 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.22 145.82 7.5 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.68 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.07 -30.21 2.85 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 109.349 -1.501 . . . . 0.0 109.349 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 80.3 m -79.89 152.87 29.38 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.155 0.502 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -136.19 150.0 27.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.504 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -119.61 120.73 37.53 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.378 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.29 178.82 53.79 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -49.93 -24.54 10.65 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 121.941 1.761 . . . . 0.0 111.795 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -57.93 -19.54 30.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.276 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.86 18.11 77.56 Favored Glycine 0 N--CA 1.486 1.973 0 O-C-N 123.492 0.495 . . . . 0.0 113.583 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -127.28 142.57 51.43 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 54.0 m -71.17 170.35 13.17 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 124.509 1.131 . . . . 0.0 110.892 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.72 0 CA-C-O 117.285 -1.842 . . . . 0.0 109.581 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.5 mmt . . . . . 0 N--CA 1.496 1.836 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.17 137.86 51.33 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 124.42 1.075 . . . . 0.0 109.376 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 2.9 p -137.63 -167.12 2.07 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.21 0.944 . . . . 0.0 111.6 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -159.91 -9.14 0.06 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -143.51 165.86 26.41 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.764 0.665 . . . . 0.0 109.894 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -54.97 -70.01 0.12 Allowed 'General case' 0 N--CA 1.49 1.575 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.908 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.1 p -74.76 11.67 1.0 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.957 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -52.73 -43.43 65.71 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 123.578 0.549 . . . . 0.0 110.696 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.6 m -92.48 -163.11 1.0 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.995 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.68 138.83 58.62 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.514 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.46 105.1 0.08 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 124.255 0.972 . . . . 0.0 111.548 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 143.65 -34.35 1.7 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.28 -1.528 . . . . 0.0 109.28 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -86.71 164.24 16.87 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 124.012 0.477 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.3 m -146.88 147.0 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 O-C-N 124.302 1.001 . . . . 0.0 109.638 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.14 141.36 35.98 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.003 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -140.8 -161.93 8.9 Favored Glycine 0 N--CA 1.483 1.776 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -53.56 -25.89 34.66 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.089 1.859 . . . . 0.0 112.74 -174.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -61.4 -19.38 61.84 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.15 -13.41 20.37 Favored Glycine 0 N--CA 1.482 1.711 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -105.86 155.41 19.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.963 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 58.5 m -60.76 166.94 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.415 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 CA-C-O 116.459 -2.301 . . . . 0.0 109.567 -179.767 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 77.4 mtp . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.17 147.87 42.21 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.02 0.825 . . . . 0.0 109.354 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.56 163.24 30.17 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.964 0.887 . . . . 0.0 112.517 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.11 -15.5 8.71 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.611 -2.086 . . . . 0.0 108.653 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -139.98 153.33 46.85 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-O 121.234 0.54 . . . . 0.0 111.066 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.17 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.137 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.2 p -71.56 9.62 0.8 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -51.38 -38.1 51.63 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 123.674 0.609 . . . . 0.0 112.141 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.5 m -79.06 -163.53 0.5 Allowed 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.174 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.95 141.23 18.26 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 123.843 0.715 . . . . 0.0 110.735 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.96 102.55 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.669 0.605 . . . . 0.0 112.309 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.61 -21.95 3.96 Favored Glycine 0 N--CA 1.498 2.794 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.811 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 5.6 m -79.28 172.95 13.09 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.26 1.028 . . . . 0.0 112.385 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.75 178.54 4.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-N 112.574 -2.103 . . . . 0.0 106.96 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.23 135.45 54.98 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.53 159.26 36.54 Favored Glycine 0 N--CA 1.481 1.634 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.229 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -51.9 -28.05 30.01 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 C-N-CA 122.09 1.86 . . . . 0.0 111.719 177.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 p30 -63.7 -9.15 12.65 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.96 -2.67 79.94 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 114.956 0.742 . . . . 0.0 114.956 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -113.36 162.69 15.77 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.29 0.567 . . . . 0.0 110.75 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.9 m -57.53 165.23 1.64 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.633 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 CA-C-O 116.516 -2.269 . . . . 0.0 110.552 179.947 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 32.5 mtp . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.74 139.02 36.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.587 1.179 . . . . 0.0 109.114 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 1.8 p -129.83 -173.85 3.15 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.379 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -139.72 -37.42 0.49 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.748 -1.114 . . . . 0.0 108.732 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.428 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 6.8 mm100 -122.38 168.36 12.17 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.909 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.452 ' OD2' HG12 ' A' ' 20' ' ' VAL . 12.4 t70 -57.43 -67.66 0.31 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 p -61.95 -1.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 114.437 -1.256 . . . . 0.0 113.801 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.428 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.1 t70 -53.43 -41.41 66.04 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.7 m -92.76 -164.06 1.13 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 113.92 -1.491 . . . . 0.0 109.079 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.7 tt -57.83 133.78 55.71 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.174 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.91 110.04 0.23 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.746 0.654 . . . . 0.0 112.508 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.29 -27.35 4.79 Favored Glycine 0 N--CA 1.495 2.593 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.522 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 m -78.83 149.77 32.45 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.431 0.634 . . . . 0.0 111.66 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.452 HG12 ' OD2' ' A' ' 12' ' ' ASP . 35.1 m -111.35 153.69 13.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 CA-C-N 113.517 -1.674 . . . . 0.0 108.402 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 t -112.57 90.87 3.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 124.475 1.109 . . . . 0.0 109.523 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.59 170.56 27.28 Favored Glycine 0 N--CA 1.488 2.155 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.612 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -51.4 -26.62 21.74 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 C-N-CA 122.265 1.977 . . . . 0.0 113.132 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -57.03 -21.7 33.12 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.71 -19.8 48.93 Favored Glycine 0 N--CA 1.477 1.412 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -98.56 144.43 27.88 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 123.663 0.272 . . . . 0.0 110.282 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.3 144.89 55.64 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.946 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.919 0 CA-C-O 115.702 -2.721 . . . . 0.0 113.368 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 40.7 ttm . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.493 HH21 ' H ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -65.69 139.87 58.42 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.835 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.5 p -100.95 128.96 46.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 ptmt -93.75 -20.19 20.35 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.95 157.75 42.2 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 114.476 -1.238 . . . . 0.0 107.795 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -54.19 -68.53 0.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.021 0.438 . . . . 0.0 111.13 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.4 p -73.33 17.67 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.756 -1.111 . . . . 0.0 113.733 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -53.3 -46.78 69.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.488 0.492 . . . . 0.0 111.688 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -79.31 -177.16 5.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.679 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.05 152.28 0.56 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.94 108.07 0.32 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.871 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.88 -22.86 4.01 Favored Glycine 0 N--CA 1.495 2.6 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.558 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.4 m -79.53 152.14 30.33 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.155 0.979 . . . . 0.0 112.767 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.4 m -144.02 151.39 16.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-N 112.539 -2.119 . . . . 0.0 105.905 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.9 t -101.66 100.56 10.96 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.306 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.31 -175.43 21.88 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -54.09 -13.97 5.51 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 122.093 1.862 . . . . 0.0 113.054 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.491 ' H ' HD22 ' A' ' 24' ' ' ASN . 0.3 OUTLIER -64.72 -20.5 66.37 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.68 -15.81 39.7 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.63 169.07 8.67 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.1 m -62.2 165.84 5.43 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.6 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.245 -179.675 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.3 ttp . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 142.43 58.4 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.357 1.036 . . . . 0.0 110.335 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.41 ' SG ' ' C ' ' A' ' 26' ' ' PHE . 31.3 p -155.89 175.06 14.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.796 0.685 . . . . 0.0 111.522 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -146.76 -11.04 0.45 Allowed 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -141.07 160.89 39.12 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 123.777 0.673 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.17 -64.3 0.88 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.8 p -61.79 -10.41 8.93 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.153 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.64 -46.26 58.27 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.68 0.613 . . . . 0.0 110.812 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.4 m -91.38 -166.11 1.5 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.156 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.53 141.19 32.16 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 123.715 0.634 . . . . 0.0 112.268 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 107.18 0.2 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.967 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.45 -20.58 5.82 Favored Glycine 0 N--CA 1.499 2.872 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.631 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.2 m -79.65 167.99 19.95 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.443 0.64 . . . . 0.0 112.398 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.6 m -130.16 157.92 42.65 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.75 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.1 t -114.0 87.84 2.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.987 0.804 . . . . 0.0 108.938 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.8 173.6 4.64 Favored Glycine 0 N--CA 1.49 2.299 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.414 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -53.72 -23.78 27.67 Favored 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 122.468 2.112 . . . . 0.0 113.19 -175.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -60.15 -14.28 16.39 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.73 9.44 87.06 Favored Glycine 0 N--CA 1.483 1.775 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.41 ' C ' ' SG ' ' A' ' 9' ' ' CYS . 7.4 m-85 -126.99 155.48 43.13 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.9 m -60.1 147.58 38.96 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.653 0.739 . . . . 0.0 110.639 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.416 0 CA-C-O 117.038 -1.979 . . . . 0.0 109.204 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.4 mtt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 120.29 0.09 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -106.21 127.76 53.46 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.521 ' SG ' ' N ' ' A' ' 10' ' ' LYS . 0.5 OUTLIER -120.97 -161.02 0.87 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 123.956 0.785 . . . . 0.0 111.239 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.521 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 1.6 tptm -152.84 -26.32 0.15 Allowed 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.984 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.423 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 mp0 -150.69 171.62 16.87 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -50.12 -75.16 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -78.68 18.14 0.62 Allowed 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.718 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 30.9 t70 -56.48 -36.2 68.83 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.618 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.4 m -79.15 -168.75 1.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.819 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.81 146.84 35.67 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.259 0.836 . . . . 0.0 113.259 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.57 104.34 0.06 Allowed 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.401 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.34 -30.7 2.5 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 2.8 m -82.87 157.48 23.08 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 122.184 0.993 . . . . 0.0 112.466 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.0 m -133.65 160.14 42.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 104.171 -2.529 . . . . 0.0 104.171 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.0 t -121.5 140.61 51.97 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.941 -0.704 . . . . 0.0 112.764 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.92 174.32 47.71 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 113.934 -1.485 . . . . 0.0 110.141 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -52.92 -30.42 48.08 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.091 1.861 . . . . 0.0 110.651 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -61.35 -9.55 5.53 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 113.662 -1.608 . . . . 0.0 114.196 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.18 17.79 76.1 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 111.9 -0.48 . . . . 0.0 111.9 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -117.19 144.0 45.24 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.967 -0.617 . . . . 0.0 109.794 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.0 m -74.12 146.74 43.31 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 124.311 1.007 . . . . 0.0 112.628 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 115.937 -2.59 . . . . 0.0 109.702 179.714 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.3 ptm . . . . . 0 N--CA 1.499 1.993 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.59 142.88 42.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.003 0.815 . . . . 0.0 108.964 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . 2.1 p -123.79 128.59 49.76 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 124.252 0.97 . . . . 0.0 112.128 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -82.71 -32.32 28.07 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.862 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -138.44 170.57 15.79 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.316 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -57.74 -60.48 3.63 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.023 0.44 . . . . 0.0 111.388 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.2 p -68.36 6.97 0.67 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.63 -45.85 63.43 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 123.47 0.481 . . . . 0.0 111.385 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -81.68 -177.14 6.42 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.487 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.92 147.46 12.19 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.044 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.34 106.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.647 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.85 -26.6 2.87 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.8 m -84.92 172.44 11.37 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.118 0.961 . . . . 0.0 111.973 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 m -141.67 165.92 17.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.887 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 t -92.98 108.91 20.37 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.207 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.16 115.86 6.18 Favored Glycine 0 N--CA 1.49 2.239 0 CA-C-O 118.23 -1.317 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.33 85.78 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 123.038 2.492 . . . . 0.0 112.19 -173.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.3 p30 177.98 -35.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.11 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.84 -42.71 0.62 Allowed Glycine 0 N--CA 1.482 1.75 0 O-C-N 123.986 0.804 . . . . 0.0 112.982 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -92.97 149.98 20.86 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.484 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 2.3 m -63.82 172.42 2.24 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 124.844 1.34 . . . . 0.0 113.019 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.469 0 CA-C-O 115.881 -2.621 . . . . 0.0 110.829 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 57.1 mtp . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.35 133.91 51.48 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 123.817 0.698 . . . . 0.0 112.604 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.58 177.9 4.65 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.967 -1.47 . . . . 0.0 109.645 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -149.8 -26.78 0.26 Allowed 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.098 -1.41 . . . . 0.0 108.205 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -155.17 167.29 30.84 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.01 -67.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.019 0.438 . . . . 0.0 110.001 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.0 p -67.36 -3.16 7.42 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.808 -1.087 . . . . 0.0 113.286 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -52.21 -38.63 58.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 123.515 0.509 . . . . 0.0 112.128 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.6 m -97.27 -164.63 1.17 Allowed 'General case' 0 N--CA 1.484 1.272 0 O-C-N 124.651 1.219 . . . . 0.0 111.091 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.3 142.16 10.55 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 124.02 0.825 . . . . 0.0 111.684 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.1 113.03 0.98 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.871 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.28 -21.64 9.24 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.163 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -79.92 162.95 24.68 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 120.563 0.22 . . . . 0.0 110.971 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.8 m -134.76 154.78 37.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 O-C-N 124.312 1.008 . . . . 0.0 110.066 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.5 t -90.35 107.11 18.94 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.747 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.31 170.22 54.49 Favored Glycine 0 N--CA 1.484 1.86 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.927 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.98 -36.26 99.18 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.416 2.078 . . . . 0.0 111.22 177.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -65.99 -1.55 3.17 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.843 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.44 13.85 82.51 Favored Glycine 0 N--CA 1.482 1.711 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.951 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -110.35 149.24 30.5 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.178 0.513 . . . . 0.0 111.605 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.0 m -62.54 165.96 5.74 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.153 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.84 0 CA-C-O 117.669 -1.629 . . . . 0.0 112.868 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.978 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.01 147.46 32.87 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.176 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.2 p -138.0 141.6 40.44 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.8 18.02 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.126 -1.397 . . . . 0.0 109.186 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -139.52 174.51 10.44 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.754 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.68 -53.11 61.35 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.282 0.563 . . . . 0.0 109.749 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 p -57.49 -11.83 2.24 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.182 -1.372 . . . . 0.0 114.184 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -49.0 -47.14 44.59 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 123.894 0.746 . . . . 0.0 112.223 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.5 m -90.82 177.91 6.19 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.487 1.117 . . . . 0.0 110.338 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.5 155.44 40.58 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.921 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.63 112.31 0.58 Allowed 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 134.7 -34.59 2.32 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -90.6 155.49 18.82 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.719 0.771 . . . . 0.0 111.235 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.1 m -128.96 167.65 23.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 CA-C-N 113.222 -1.808 . . . . 0.0 107.506 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 t -111.19 111.68 22.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 123.674 0.609 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.73 147.81 26.91 Favored Glycine 0 CA--C 1.541 1.705 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -52.45 -21.49 14.06 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.315 2.01 . . . . 0.0 113.145 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.416 ' H ' HD22 ' A' ' 24' ' ' ASN . 1.6 p30 -56.43 -27.08 55.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 124.132 0.895 . . . . 0.0 113.26 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 122.54 -38.96 2.4 Favored Glycine 0 N--CA 1.481 1.676 0 O-C-N 123.947 0.779 . . . . 0.0 111.205 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -93.59 158.08 15.87 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 115.233 -0.484 . . . . 0.0 111.301 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.89 178.28 2.25 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.747 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 179.833 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 110.048 -1.221 . . . . 0.0 110.048 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 t -126.63 104.15 24.36 Favored Pre-proline 0 N--CA 1.496 1.867 0 CA-C-N 114.924 -0.638 . . . . 0.0 109.919 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -67.01 -168.3 0.16 Allowed 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.864 1.709 . . . . 0.0 111.88 173.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -159.49 137.25 10.08 Favored 'General case' 0 N--CA 1.483 1.197 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.756 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 178.62 171.06 0.81 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.46 -1.246 . . . . 0.0 108.517 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.34 83.16 0.15 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.865 0.84 . . . . 0.0 110.291 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 24.3 mmm -124.96 103.97 8.32 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -60.81 138.05 58.15 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 124.579 1.174 . . . . 0.0 111.837 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -126.46 163.8 22.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 124.319 1.012 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -138.69 -20.97 1.01 Allowed 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.288 -1.778 . . . . 0.0 108.393 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -145.34 163.25 35.13 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.388 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -57.31 -57.65 11.69 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.527 0.68 . . . . 0.0 109.948 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.3 p -54.63 -13.12 0.89 Allowed 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 113.879 -1.51 . . . . 0.0 114.458 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -47.12 -45.72 22.49 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.029 0.831 . . . . 0.0 112.113 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.2 m -89.57 -169.69 2.57 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.991 -1.913 . . . . 0.0 111.471 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mt -75.78 144.97 41.09 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.549 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.03 106.92 0.1 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 124.238 0.962 . . . . 0.0 111.24 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.77 -35.33 1.79 Allowed Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 3.8 m -89.02 172.13 9.34 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.742 0.782 . . . . 0.0 111.301 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.2 m -135.6 167.23 25.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 CA-C-N 113.293 -1.776 . . . . 0.0 107.028 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 t -74.96 98.11 3.51 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.238 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.503 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -49.2 112.06 1.19 Allowed Glycine 0 N--CA 1.494 2.5 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.39 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo -62.19 85.99 0.1 Allowed 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 123.321 2.681 . . . . 0.0 110.675 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.401 HD22 ' H ' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -179.76 -35.58 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.198 -179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.08 -53.46 0.4 Allowed Glycine 0 N--CA 1.48 1.619 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.401 ' H ' HD22 ' A' ' 24' ' ' ASN . 5.7 m-85 -96.96 162.21 13.49 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.114 -0.543 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.503 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 63.8 m -51.25 159.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 125.002 1.439 . . . . 0.0 113.205 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.642 0 CA-C-O 117.297 -1.835 . . . . 0.0 111.048 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.8 t -74.23 144.77 82.13 Favored Pre-proline 0 N--CA 1.494 1.769 0 CA-C-O 119.003 -0.523 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -59.75 -165.84 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.382 2.055 . . . . 0.0 113.228 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 70.2 mtt-85 -43.12 125.23 3.56 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.859 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.7 132.79 26.23 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.649 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 6.5 mp 52.99 79.21 0.12 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 124.84 1.338 . . . . 0.0 112.534 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.5 141.88 36.23 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.28 129.09 40.39 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 123.759 0.662 . . . . 0.0 109.796 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER -138.73 133.63 32.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.003 0.814 . . . . 0.0 111.73 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -85.53 -28.03 25.2 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.212 -1.358 . . . . 0.0 109.712 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -132.78 165.73 23.88 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.314 1.009 . . . . 0.0 110.115 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.4 -56.65 17.91 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.0 p -65.64 1.69 1.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.234 -1.348 . . . . 0.0 113.972 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.86 -46.23 51.28 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.659 0.6 . . . . 0.0 111.703 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.1 m -85.04 -178.21 6.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.026 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 143.76 43.62 Favored 'General case' 0 N--CA 1.5 2.073 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.832 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.68 103.56 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.154 0.909 . . . . 0.0 111.318 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 142.62 -32.39 1.95 Allowed Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.5 m -79.85 166.46 21.67 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.965 0.412 . . . . 0.0 109.974 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.3 m -146.39 147.33 18.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.851 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -104.91 118.26 36.09 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 113.44 -1.709 . . . . 0.0 108.736 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.74 178.42 53.3 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -51.57 -24.06 16.25 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.869 1.712 . . . . 0.0 111.372 170.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -60.68 -18.91 56.81 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 114.551 -1.204 . . . . 0.0 113.323 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.66 5.1 89.76 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -122.35 143.89 49.36 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.336 0.589 . . . . 0.0 110.134 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 73.2 m -64.4 172.5 2.53 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.159 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.677 0 CA-C-O 116.527 -2.263 . . . . 0.0 110.2 179.768 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.519 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 8.5 t -58.04 -40.99 87.44 Favored Pre-proline 0 N--CA 1.495 1.792 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' A' ' 2' ' ' CYS . 3.0 Cg_endo -70.83 129.99 17.33 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.447 2.098 . . . . 0.0 109.691 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.71 -172.1 2.04 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.263 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.19 -179.26 0.14 Allowed 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.738 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.675 ' HB3' HH21 ' A' ' 8' ' ' ARG . 3.6 mm? -48.83 82.27 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 O-C-N 124.472 1.107 . . . . 0.0 113.559 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 46.2 ttm -98.16 107.83 20.39 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.215 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.675 HH21 ' HB3' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -78.32 150.37 33.29 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.367 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.0 155.22 19.6 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.774 0.797 . . . . 0.0 111.183 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -124.12 -19.56 5.56 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.078 -1.874 . . . . 0.0 107.413 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -150.86 154.27 36.9 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -53.81 -44.3 70.08 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.141 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.8 p -79.2 22.46 0.41 Allowed 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 114.491 -1.232 . . . . 0.0 113.443 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -52.68 -36.37 56.93 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -93.34 -173.78 3.33 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.204 0.94 . . . . 0.0 110.821 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD12 ' A' ' 16' ' ' LEU . 5.1 mp -57.3 147.43 25.62 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.712 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.21 108.02 0.17 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.695 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.57 -32.78 2.35 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.2 m -81.11 165.18 21.84 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.012 -0.594 . . . . 0.0 110.057 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.55 154.39 12.39 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.269 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -84.34 140.56 31.51 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.037 -1.098 . . . . 0.0 108.037 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.89 168.21 24.63 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -52.77 -28.7 39.3 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 C-N-CA 122.1 1.867 . . . . 0.0 111.743 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p30 -60.4 -15.72 28.9 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.815 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.58 0.09 79.61 Favored Glycine 0 N--CA 1.481 1.654 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -110.02 163.44 13.57 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -58.41 173.59 0.37 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.874 0.845 . . . . 0.0 111.87 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.45 0 CA-C-O 116.156 -2.469 . . . . 0.0 109.559 179.961 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 52.0 t -126.59 83.1 65.57 Favored Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -62.01 104.7 0.35 Allowed 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 122.147 1.898 . . . . 0.0 110.685 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -169.21 153.71 5.56 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.461 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 mp -57.21 153.16 12.41 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.419 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.3 mp -56.34 100.0 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 124.245 0.965 . . . . 0.0 111.204 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.6 ttt -126.04 130.79 51.84 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -72.14 145.44 48.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.473 1.108 . . . . 0.0 110.824 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.73 166.89 10.35 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.558 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -118.6 -26.48 6.15 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 113.403 -1.726 . . . . 0.0 107.21 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.472 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 0.3 OUTLIER -152.34 172.62 16.18 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.827 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.2 -56.91 16.12 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.343 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.7 p -71.77 3.04 4.5 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.4 t70 -48.18 -46.18 34.55 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 m -78.51 -171.72 2.59 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.6 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 mt -47.9 141.29 5.9 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.92 107.04 0.22 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.614 0.571 . . . . 0.0 110.958 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.58 -21.92 4.19 Favored Glycine 0 N--CA 1.498 2.769 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.236 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.2 m -78.95 173.93 12.05 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.147 0.975 . . . . 0.0 111.532 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.6 m -143.04 170.04 11.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-N 112.765 -2.016 . . . . 0.0 106.564 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 t -114.95 140.38 49.05 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.465 ' C ' HD22 ' A' ' 24' ' ' ASN . . . -97.37 160.18 21.26 Favored Glycine 0 CA--C 1.538 1.478 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -52.01 -22.41 14.46 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.919 1.746 . . . . 0.0 112.409 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.595 ' H ' HD22 ' A' ' 24' ' ' ASN . 0.0 OUTLIER -60.62 -14.82 22.65 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.43 -21.46 46.0 Favored Glycine 0 N--CA 1.48 1.584 0 O-C-N 123.687 0.617 . . . . 0.0 112.117 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -102.04 168.62 9.27 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 120.776 0.322 . . . . 0.0 110.783 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 72.1 m -50.55 164.61 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 124.547 1.154 . . . . 0.0 111.207 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 -179.538 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.7 t -120.67 100.98 46.31 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 124.215 0.597 . . . . 0.0 110.327 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -67.44 169.16 16.17 Favored 'Trans proline' 0 N--CA 1.487 1.112 0 C-N-CA 121.97 1.78 . . . . 0.0 110.913 165.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.6 73.51 2.6 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.803 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 tt -62.4 145.94 52.67 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.331 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 79.51 0.31 Allowed 'General case' 0 N--CA 1.486 1.336 0 O-C-N 124.424 1.077 . . . . 0.0 111.594 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.49 129.04 12.23 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.206 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.19 146.24 39.27 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 124.758 1.286 . . . . 0.0 110.754 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 4.2 p -139.42 -172.8 3.44 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.097 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -158.74 -13.79 0.07 Allowed 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.592 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -131.5 159.72 37.3 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.84 -65.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 82.5 p -72.05 9.13 1.02 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 114.724 -1.126 . . . . 0.0 113.135 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -50.2 -48.92 54.04 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 123.674 0.609 . . . . 0.0 111.28 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 3.9 m -86.21 -166.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 114.053 -1.431 . . . . 0.0 111.669 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' H ' HD12 ' A' ' 16' ' ' LEU . 2.4 mp -50.78 134.95 24.6 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.047 0.842 . . . . 0.0 111.91 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.81 109.04 0.21 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 123.659 0.6 . . . . 0.0 112.086 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 131.54 -30.08 3.33 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 25.5 m -81.53 161.51 23.56 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.471 0.653 . . . . 0.0 110.595 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.3 m -132.92 161.88 40.9 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 CA-C-N 113.91 -1.496 . . . . 0.0 108.004 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 t -105.59 119.34 38.87 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.92 172.98 48.53 Favored Glycine 0 N--CA 1.481 1.674 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -57.76 -20.18 42.02 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.748 1.632 . . . . 0.0 111.099 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.509 HD22 ' HB2' ' A' ' 26' ' ' PHE . 7.8 p-10 -66.09 -10.29 39.11 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.183 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.18 -7.53 67.05 Favored Glycine 0 N--CA 1.483 1.781 0 CA-C-O 119.903 -0.387 . . . . 0.0 114.006 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HB2' HD22 ' A' ' 24' ' ' ASN . 5.5 m-85 -115.1 161.11 18.83 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.466 0.65 . . . . 0.0 110.687 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.9 m -68.24 143.31 55.33 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-N 114.622 -1.172 . . . . 0.0 113.473 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 CA-C-O 115.9 -2.611 . . . . 0.0 107.594 179.628 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.329 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.7 t -71.81 124.74 91.34 Favored Pre-proline 0 N--CA 1.497 1.909 0 CA-C-O 119.076 -0.488 . . . . 0.0 110.307 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -66.98 -166.43 0.12 Allowed 'Trans proline' 0 N--CA 1.49 1.271 0 C-N-CA 122.507 2.138 . . . . 0.0 111.959 173.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.581 ' C ' HD22 ' A' ' 5' ' ' LEU . 26.3 tpt180 -163.91 81.35 0.43 Allowed 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 114.667 -1.151 . . . . 0.0 107.96 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.581 HD22 ' C ' ' A' ' 4' ' ' ARG . 4.0 mm? -128.11 135.56 49.96 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 113.571 -1.65 . . . . 0.0 107.868 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.83 93.8 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 O-C-N 124.204 0.94 . . . . 0.0 111.062 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 42.1 mtt -137.9 132.19 32.08 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.593 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -72.63 146.98 46.23 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 124.122 0.889 . . . . 0.0 111.255 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.8 p -141.68 162.13 36.24 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.108 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 pttm -131.19 -6.55 3.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 113.65 -1.614 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 10.2 mm-40 -133.96 153.28 51.88 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 123.982 0.801 . . . . 0.0 110.876 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.19 -61.1 2.8 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.4 p -69.09 4.46 1.58 Allowed 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.992 -1.458 . . . . 0.0 112.849 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 22.3 t0 -53.36 -45.44 69.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 123.519 0.512 . . . . 0.0 110.636 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.2 -174.67 5.18 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 124.188 0.93 . . . . 0.0 110.059 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.31 162.82 21.96 Favored 'General case' 0 N--CA 1.499 2.02 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.95 124.37 8.59 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.118 -1.401 . . . . 0.0 112.262 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.34 -24.8 21.72 Favored Glycine 0 N--CA 1.495 2.621 0 O-C-N 124.574 1.171 . . . . 0.0 112.226 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.3 m -86.37 170.43 12.02 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.718 0.77 . . . . 0.0 112.075 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -146.47 161.13 10.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.493 -1.685 . . . . 0.0 106.52 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.94 101.27 8.52 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.838 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.425 ' H ' ' HA ' ' A' ' 27' ' ' CYS . . . -53.29 115.23 4.46 Favored Glycine 0 N--CA 1.491 2.314 0 CA-C-O 118.374 -1.237 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -59.53 87.88 0.07 OUTLIER 'Trans proline' 0 N--CA 1.488 1.182 0 C-N-CA 122.833 2.355 . . . . 0.0 110.835 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.496 HD22 ' H ' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -177.67 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 112.13 -2.304 . . . . 0.0 107.94 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 152.94 -49.31 0.52 Allowed Glycine 0 N--CA 1.482 1.753 0 O-C-N 124.094 0.871 . . . . 0.0 111.933 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.496 ' H ' HD22 ' A' ' 24' ' ' ASN . 5.7 m-85 -95.67 161.14 14.16 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 114.933 -0.633 . . . . 0.0 111.469 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HA ' ' H ' ' A' ' 22' ' ' GLY . 92.8 m -63.6 165.17 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.557 1.161 . . . . 0.0 110.564 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.018 -1.99 . . . . 0.0 110.456 179.793 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.369 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.591 ' SG ' HD21 ' A' ' 5' ' ' LEU . 42.2 t -71.94 130.55 86.58 Favored Pre-proline 0 N--CA 1.495 1.816 0 CA-C-N 115.003 -0.598 . . . . 0.0 110.158 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.27 -179.56 0.64 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.277 1.984 . . . . 0.0 112.947 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 119.75 3.57 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.591 HD21 ' SG ' ' A' ' 2' ' ' CYS . 25.0 mt -89.25 111.67 22.54 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.12 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -179.62 41.03 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 124.089 0.868 . . . . 0.0 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.66 143.52 33.65 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.703 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -65.77 145.08 56.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 124.653 1.22 . . . . 0.0 110.697 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.5 p -124.67 119.46 29.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.067 0.854 . . . . 0.0 112.769 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.11 -20.72 26.67 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.068 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -136.25 161.86 34.6 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.301 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.23 -49.73 75.93 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -78.42 16.8 0.74 Allowed 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.163 -1.835 . . . . 0.0 113.272 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.7 -49.26 73.45 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.316 0.385 . . . . 0.0 110.794 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.8 m -81.62 -176.28 5.98 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.087 0.867 . . . . 0.0 110.303 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.96 151.58 21.6 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.56 111.0 0.57 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.557 -1.201 . . . . 0.0 110.724 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.13 -30.97 2.75 Favored Glycine 0 N--CA 1.494 2.565 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -83.41 178.15 8.16 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 121.422 0.629 . . . . 0.0 110.885 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -151.43 166.08 2.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-N 114.091 -1.413 . . . . 0.0 107.332 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.36 105.14 17.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.67 0.606 . . . . 0.0 109.562 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.16 146.56 44.65 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -51.2 -24.73 15.75 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 122.305 2.003 . . . . 0.0 112.865 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.57 -19.23 14.82 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 111.77 -25.6 12.92 Favored Glycine 0 N--CA 1.482 1.745 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.05 164.98 11.34 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.196 -0.502 . . . . 0.0 109.661 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.8 m -63.01 158.62 18.97 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 CA-C-O 116.174 -2.459 . . . . 0.0 107.696 -179.828 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.8 t -65.42 133.51 95.39 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.953 -0.546 . . . . 0.0 110.808 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -63.13 151.21 85.94 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.135 1.89 . . . . 0.0 111.979 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.67 139.3 50.79 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.766 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -170.47 112.47 0.42 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 124.108 0.88 . . . . 0.0 109.936 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.61 91.49 0.8 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.82 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.9 mtt -142.41 129.18 20.49 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.723 -1.126 . . . . 0.0 108.601 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HG3' ' CZ ' ' A' ' 26' ' ' PHE . 30.0 mtm-85 -70.4 132.01 44.96 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.849 1.343 . . . . 0.0 109.986 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.73 177.67 4.78 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.874 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -136.55 -11.62 1.83 Allowed 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.942 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -156.89 166.84 32.23 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -52.96 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.344 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -79.36 18.09 0.75 Allowed 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.917 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -53.77 -38.84 64.86 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.485 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 m -79.48 -166.22 0.93 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.737 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -48.65 141.1 7.49 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.71 0.631 . . . . 0.0 112.543 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.5 107.84 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.001 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.47 -23.51 4.53 Favored Glycine 0 N--CA 1.497 2.758 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.1 m -79.6 160.03 26.57 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 122.063 0.935 . . . . 0.0 112.919 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.4 m -130.79 159.93 42.41 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 CA-C-N 112.751 -2.022 . . . . 0.0 106.089 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -119.7 87.9 2.83 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.09 176.43 3.65 Favored Glycine 0 N--CA 1.49 2.273 0 CA-C-N 115.685 -0.688 . . . . 0.0 113.322 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -58.54 86.17 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.254 0 C-N-CA 122.884 2.389 . . . . 0.0 110.103 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 p30 179.65 -25.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 112.938 -1.937 . . . . 0.0 109.188 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.23 19.93 76.12 Favored Glycine 0 N--CA 1.487 2.069 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.832 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.404 ' CZ ' ' HG3' ' A' ' 8' ' ' ARG . 10.4 m-85 -124.85 147.55 48.7 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.2 m -61.65 136.4 57.99 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.153 -1.019 . . . . 0.0 108.679 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 116.115 -2.492 . . . . 0.0 108.335 -179.847 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.523 ' SG ' HD21 ' A' ' 5' ' ' LEU . 42.8 t -80.82 132.13 58.4 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.866 -0.588 . . . . 0.0 110.778 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -65.72 -169.68 0.16 Allowed 'Trans proline' 0 N--CA 1.492 1.428 0 C-N-CA 122.219 1.946 . . . . 0.0 111.403 170.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -59.39 137.22 58.07 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.523 HD21 ' SG ' ' A' ' 2' ' ' CYS . 4.3 mm? -93.57 160.14 14.92 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.049 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -175.82 37.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.923 -1.035 . . . . 0.0 109.75 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 82.9 mtp -142.35 149.92 40.06 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.179 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -66.57 151.3 47.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.231 0.957 . . . . 0.0 110.401 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.4 t -100.08 172.03 7.45 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.015 0.912 . . . . 0.0 112.55 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -160.5 13.39 0.11 Allowed 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 113.077 -1.874 . . . . 0.0 108.252 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 140.07 169.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 126.867 2.067 . . . . 0.0 108.907 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.81 -55.46 26.37 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 121.552 0.691 . . . . 0.0 109.444 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.4 p -62.11 -14.2 34.36 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 113.817 -1.538 . . . . 0.0 114.43 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -50.82 -49.2 59.21 Favored 'General case' 0 N--CA 1.503 2.18 0 CA-C-O 121.886 0.85 . . . . 0.0 111.339 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -79.6 -170.85 2.53 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 112.858 -1.974 . . . . 0.0 109.538 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.65 141.07 53.69 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.32 103.54 0.05 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 123.836 0.71 . . . . 0.0 110.803 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 145.83 -31.64 1.61 Allowed Glycine 0 N--CA 1.496 2.652 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.1 m -79.97 -169.84 2.19 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.1 m -145.74 179.58 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -99.63 94.9 6.61 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.383 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.07 109.62 2.55 Favored Glycine 0 N--CA 1.489 2.169 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.089 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -50.3 -27.01 16.85 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.641 2.227 . . . . 0.0 113.908 -165.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -52.05 -32.75 35.89 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.863 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.82 -33.62 1.27 Allowed Glycine 0 N--CA 1.485 1.955 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -101.06 174.65 5.9 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.932 -0.634 . . . . 0.0 109.563 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 65.0 m -61.01 179.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.304 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.832 0 CA-C-O 116.451 -2.305 . . . . 0.0 113.659 -179.879 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 15' ' ' CYS . 9.1 t -145.93 75.57 12.96 Favored Pre-proline 0 N--CA 1.495 1.797 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -67.36 137.69 44.12 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 121.893 1.728 . . . . 0.0 109.862 174.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.35 114.8 0.67 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.52 1.138 . . . . 0.0 112.395 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tp -171.22 159.64 5.93 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.46 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 6' ' ' LEU . 7.2 mp -84.06 47.93 1.39 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.069 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 ptp -77.09 130.02 36.83 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.81 131.39 50.19 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 123.996 0.81 . . . . 0.0 111.902 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -93.16 -159.4 0.68 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.754 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 -18.37 0.09 Allowed 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 113.975 -1.466 . . . . 0.0 108.592 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.42 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 10.8 mt-30 -160.45 168.4 25.21 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -58.07 -62.78 1.57 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.841 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.9 p -77.02 24.56 0.16 Allowed 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.413 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 4.4 t70 -48.72 -52.83 21.51 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.433 ' HB3' ' SG ' ' A' ' 2' ' ' CYS . 89.4 m -80.78 -178.88 7.01 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-N 113.757 -1.565 . . . . 0.0 112.321 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -53.49 146.08 13.48 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.27 102.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.875 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 144.29 -34.0 1.66 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 108.731 -1.748 . . . . 0.0 108.731 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.5 m -86.31 163.14 17.87 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 114.948 -0.626 . . . . 0.0 109.328 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.1 155.11 6.77 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.705 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.8 t -98.02 128.08 44.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.65 1.219 . . . . 0.0 109.639 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -91.51 178.41 41.3 Favored Glycine 0 N--CA 1.479 1.547 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -53.26 -26.42 34.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 121.968 1.779 . . . . 0.0 110.734 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -59.88 -14.93 17.58 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.25 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.49 -13.0 54.03 Favored Glycine 0 N--CA 1.481 1.638 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -101.16 153.53 19.51 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.242 0.544 . . . . 0.0 111.584 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.41 178.31 2.98 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.549 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 2.801 0 CA-C-O 114.96 -3.133 . . . . 0.0 114.414 179.784 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 t -119.37 93.31 47.05 Favored Pre-proline 0 N--CA 1.496 1.854 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -62.42 119.7 6.91 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 C-N-CA 121.581 1.521 . . . . 0.0 110.9 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -51.85 142.95 14.2 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.672 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.39 133.36 1.71 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 tt -58.35 96.59 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 124.252 0.97 . . . . 0.0 109.812 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.3 mmm -140.59 115.91 9.98 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.294 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.79 143.98 57.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 124.162 0.914 . . . . 0.0 108.877 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -118.07 -161.23 0.82 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.217 0.948 . . . . 0.0 111.581 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 -23.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.516 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.451 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 57.4 mt-30 -148.6 167.08 26.4 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.077 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -62.61 -54.07 45.05 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -74.73 8.42 2.42 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.771 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.451 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 7.0 t70 -48.76 -49.02 40.4 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 123.664 0.603 . . . . 0.0 111.584 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.5 m -84.54 -179.53 7.17 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.764 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -51.22 145.82 7.5 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.68 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.07 -30.21 2.85 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 109.349 -1.501 . . . . 0.0 109.349 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 80.3 m -79.89 152.87 29.38 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.155 0.502 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -136.19 150.0 27.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 114.278 -1.328 . . . . 0.0 110.504 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.5 t -119.61 120.73 37.53 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 113.3 -1.773 . . . . 0.0 109.378 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.29 178.82 53.79 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -49.93 -24.54 10.65 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 121.941 1.761 . . . . 0.0 111.795 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -57.93 -19.54 30.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.276 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.86 18.11 77.56 Favored Glycine 0 N--CA 1.486 1.973 0 O-C-N 123.492 0.495 . . . . 0.0 113.583 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -127.28 142.57 51.43 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 54.0 m -71.17 170.35 13.17 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 124.509 1.131 . . . . 0.0 110.892 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.72 0 CA-C-O 117.285 -1.842 . . . . 0.0 109.581 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.14 126.66 91.76 Favored Pre-proline 0 N--CA 1.497 1.905 0 CA-C-N 114.844 -0.678 . . . . 0.0 110.635 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -64.28 121.43 9.06 Favored 'Trans proline' 0 N--CA 1.488 1.17 0 C-N-CA 121.849 1.7 . . . . 0.0 110.395 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -57.78 109.4 0.71 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 124.219 0.95 . . . . 0.0 110.562 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -172.7 124.91 0.47 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.044 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.15 71.49 5.65 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 122.061 0.934 . . . . 0.0 111.483 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.5 mmt -90.72 137.13 32.6 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.328 -1.306 . . . . 0.0 108.232 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.17 137.86 51.33 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 124.42 1.075 . . . . 0.0 109.376 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 2.9 p -137.63 -167.12 2.07 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 124.21 0.944 . . . . 0.0 111.6 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -159.91 -9.14 0.06 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -143.51 165.86 26.41 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.764 0.665 . . . . 0.0 109.894 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -54.97 -70.01 0.12 Allowed 'General case' 0 N--CA 1.49 1.575 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.908 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.1 p -74.76 11.67 1.0 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.957 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -52.73 -43.43 65.71 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 123.578 0.549 . . . . 0.0 110.696 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.6 m -92.48 -163.11 1.0 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.995 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.68 138.83 58.62 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.514 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.46 105.1 0.08 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 124.255 0.972 . . . . 0.0 111.548 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 143.65 -34.35 1.7 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.28 -1.528 . . . . 0.0 109.28 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -86.71 164.24 16.87 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 124.012 0.477 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.3 m -146.88 147.0 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 O-C-N 124.302 1.001 . . . . 0.0 109.638 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.14 141.36 35.98 Favored 'General case' 0 N--CA 1.499 1.985 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.003 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -140.8 -161.93 8.9 Favored Glycine 0 N--CA 1.483 1.776 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -53.56 -25.89 34.66 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.089 1.859 . . . . 0.0 112.74 -174.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -61.4 -19.38 61.84 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.15 -13.41 20.37 Favored Glycine 0 N--CA 1.482 1.711 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -105.86 155.41 19.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.963 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 58.5 m -60.76 166.94 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.415 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.526 0 CA-C-O 116.459 -2.301 . . . . 0.0 109.567 -179.767 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 110.116 -1.193 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.524 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 8.2 t -62.92 -39.98 58.3 Favored Pre-proline 0 N--CA 1.495 1.783 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.524 ' CD ' ' N ' ' A' ' 2' ' ' CYS . 6.0 Cg_exo -68.91 125.04 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 C-N-CA 122.506 2.138 . . . . 0.0 109.085 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -166.94 -170.71 1.61 Allowed 'General case' 0 N--CA 1.485 1.318 0 O-C-N 124.555 1.159 . . . . 0.0 109.791 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 pp -59.56 -173.82 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.955 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.3 mt -54.92 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 123.895 0.747 . . . . 0.0 112.228 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 77.4 mtp -101.88 94.74 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 114.422 -1.263 . . . . 0.0 107.958 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.17 147.87 42.21 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.02 0.825 . . . . 0.0 109.354 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.56 163.24 30.17 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.964 0.887 . . . . 0.0 112.517 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.11 -15.5 8.71 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.611 -2.086 . . . . 0.0 108.653 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -139.98 153.33 46.85 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-O 121.234 0.54 . . . . 0.0 111.066 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -53.17 -69.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.137 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.2 p -71.56 9.62 0.8 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -51.38 -38.1 51.63 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 123.674 0.609 . . . . 0.0 112.141 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.5 m -79.06 -163.53 0.5 Allowed 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.174 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.95 141.23 18.26 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 123.843 0.715 . . . . 0.0 110.735 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -51.96 102.55 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.669 0.605 . . . . 0.0 112.309 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.61 -21.95 3.96 Favored Glycine 0 N--CA 1.498 2.794 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.811 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 5.6 m -79.28 172.95 13.09 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.26 1.028 . . . . 0.0 112.385 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.75 178.54 4.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-N 112.574 -2.103 . . . . 0.0 106.96 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.23 135.45 54.98 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -83.53 159.26 36.54 Favored Glycine 0 N--CA 1.481 1.634 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.229 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -51.9 -28.05 30.01 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 C-N-CA 122.09 1.86 . . . . 0.0 111.719 177.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 p30 -63.7 -9.15 12.65 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.96 -2.67 79.94 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 114.956 0.742 . . . . 0.0 114.956 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -113.36 162.69 15.77 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.29 0.567 . . . . 0.0 110.75 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.9 m -57.53 165.23 1.64 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.633 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.485 0 CA-C-O 116.516 -2.269 . . . . 0.0 110.552 179.947 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.372 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 43.9 t -70.03 132.84 88.17 Favored Pre-proline 0 N--CA 1.497 1.903 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.79 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -64.28 148.39 91.04 Favored 'Trans proline' 0 N--CA 1.49 1.279 0 C-N-CA 121.935 1.757 . . . . 0.0 110.416 169.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.97 86.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.792 1.307 . . . . 0.0 114.216 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.07 112.09 8.78 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.845 -1.071 . . . . 0.0 108.123 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 mp -80.06 60.68 3.67 Favored 'General case' 0 N--CA 1.482 1.16 0 O-C-N 124.312 1.008 . . . . 0.0 110.819 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 32.5 mtp -143.7 142.74 31.11 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.502 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.74 139.02 36.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.587 1.179 . . . . 0.0 109.114 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 1.8 p -129.83 -173.85 3.15 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.379 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -139.72 -37.42 0.49 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.748 -1.114 . . . . 0.0 108.732 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.428 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 6.8 mm100 -122.38 168.36 12.17 Favored 'General case' 0 N--CA 1.501 2.111 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.909 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.452 ' OD2' HG12 ' A' ' 20' ' ' VAL . 12.4 t70 -57.43 -67.66 0.31 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 p -61.95 -1.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 114.437 -1.256 . . . . 0.0 113.801 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.428 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 10.1 t70 -53.43 -41.41 66.04 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 1.7 m -92.76 -164.06 1.13 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 113.92 -1.491 . . . . 0.0 109.079 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.7 tt -57.83 133.78 55.71 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.174 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.91 110.04 0.23 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 123.746 0.654 . . . . 0.0 112.508 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.29 -27.35 4.79 Favored Glycine 0 N--CA 1.495 2.593 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.522 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 m -78.83 149.77 32.45 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.431 0.634 . . . . 0.0 111.66 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.452 HG12 ' OD2' ' A' ' 12' ' ' ASP . 35.1 m -111.35 153.69 13.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.276 0 CA-C-N 113.517 -1.674 . . . . 0.0 108.402 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 t -112.57 90.87 3.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 124.475 1.109 . . . . 0.0 109.523 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.59 170.56 27.28 Favored Glycine 0 N--CA 1.488 2.155 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.612 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -51.4 -26.62 21.74 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 C-N-CA 122.265 1.977 . . . . 0.0 113.132 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -57.03 -21.7 33.12 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.71 -19.8 48.93 Favored Glycine 0 N--CA 1.477 1.412 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -98.56 144.43 27.88 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 123.663 0.272 . . . . 0.0 110.282 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 m -67.3 144.89 55.64 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.946 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.919 0 CA-C-O 115.702 -2.721 . . . . 0.0 113.368 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.391 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t -147.08 85.42 6.93 Favored Pre-proline 0 N--CA 1.493 1.699 0 O-C-N 124.125 0.544 . . . . 0.0 109.835 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -64.35 125.22 14.65 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 C-N-CA 121.986 1.791 . . . . 0.0 110.884 176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.13 138.98 48.78 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.306 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.8 tp -168.61 148.85 4.54 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.581 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.52 95.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.485 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 40.7 ttm -160.2 105.3 1.51 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.299 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.493 HH21 ' H ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -65.69 139.87 58.42 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.835 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.5 p -100.95 128.96 46.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 ptmt -93.75 -20.19 20.35 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 179.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.95 157.75 42.2 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 114.476 -1.238 . . . . 0.0 107.795 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -54.19 -68.53 0.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.021 0.438 . . . . 0.0 111.13 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.4 p -73.33 17.67 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.756 -1.111 . . . . 0.0 113.733 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -53.3 -46.78 69.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.488 0.492 . . . . 0.0 111.688 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -79.31 -177.16 5.57 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.679 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.05 152.28 0.56 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.94 108.07 0.32 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.871 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 132.88 -22.86 4.01 Favored Glycine 0 N--CA 1.495 2.6 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.558 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 18.4 m -79.53 152.14 30.33 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.155 0.979 . . . . 0.0 112.767 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.4 m -144.02 151.39 16.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-N 112.539 -2.119 . . . . 0.0 105.905 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.9 t -101.66 100.56 10.96 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.306 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.31 -175.43 21.88 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -54.09 -13.97 5.51 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 122.093 1.862 . . . . 0.0 113.054 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.491 ' H ' HD22 ' A' ' 24' ' ' ASN . 0.3 OUTLIER -64.72 -20.5 66.37 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.68 -15.81 39.7 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.63 169.07 8.67 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.1 m -62.2 165.84 5.43 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.6 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.245 -179.675 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.373 0 N-CA-C 110.684 -0.966 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.21 135.3 79.68 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-N 115.114 -0.543 . . . . 0.0 110.376 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -66.4 139.68 55.16 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 121.96 1.773 . . . . 0.0 110.491 170.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.84 49.52 0.78 Allowed 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.39 107.07 0.52 Allowed 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.55 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.6 tt -62.96 93.37 0.06 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 54.3 ttp -140.92 143.14 34.43 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 114.534 -1.212 . . . . 0.0 109.173 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 142.43 58.4 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.357 1.036 . . . . 0.0 110.335 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' SG ' ' C ' ' A' ' 26' ' ' PHE . 31.3 p -155.89 175.06 14.44 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.796 0.685 . . . . 0.0 111.522 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -146.76 -11.04 0.45 Allowed 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -141.07 160.89 39.12 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 123.777 0.673 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.17 -64.3 0.88 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.8 p -61.79 -10.41 8.93 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.153 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.64 -46.26 58.27 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 123.68 0.613 . . . . 0.0 110.812 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.4 m -91.38 -166.11 1.5 Allowed 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.156 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.53 141.19 32.16 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 123.715 0.634 . . . . 0.0 112.268 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 107.18 0.2 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.967 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.45 -20.58 5.82 Favored Glycine 0 N--CA 1.499 2.872 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.631 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.2 m -79.65 167.99 19.95 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 121.443 0.64 . . . . 0.0 112.398 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.6 m -130.16 157.92 42.65 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.75 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.1 t -114.0 87.84 2.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.987 0.804 . . . . 0.0 108.938 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.8 173.6 4.64 Favored Glycine 0 N--CA 1.49 2.299 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.414 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -53.72 -23.78 27.67 Favored 'Trans proline' 0 N--CA 1.491 1.343 0 C-N-CA 122.468 2.112 . . . . 0.0 113.19 -175.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -60.15 -14.28 16.39 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.73 9.44 87.06 Favored Glycine 0 N--CA 1.483 1.775 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.41 ' C ' ' SG ' ' A' ' 9' ' ' CYS . 7.4 m-85 -126.99 155.48 43.13 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.9 m -60.1 147.58 38.96 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.653 0.739 . . . . 0.0 110.639 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.416 0 CA-C-O 117.038 -1.979 . . . . 0.0 109.204 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 111.466 -0.654 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.1 t -123.59 84.5 53.2 Favored Pre-proline 0 N--CA 1.493 1.677 0 CA-C-N 114.027 -1.087 . . . . 0.0 109.353 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -60.77 145.8 98.37 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.474 2.116 . . . . 0.0 112.688 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.29 124.82 21.45 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.885 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.41 -172.9 0.18 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 124.304 1.002 . . . . 0.0 108.783 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.84 123.58 14.73 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 123.476 0.485 . . . . 0.0 109.825 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 45.4 mtt -86.27 49.77 1.86 Allowed 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.793 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -106.21 127.76 53.46 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.521 ' SG ' ' N ' ' A' ' 10' ' ' LYS . 0.5 OUTLIER -120.97 -161.02 0.87 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 123.956 0.785 . . . . 0.0 111.239 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.521 ' N ' ' SG ' ' A' ' 9' ' ' CYS . 1.6 tptm -152.84 -26.32 0.15 Allowed 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.984 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.423 ' H ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 mp0 -150.69 171.62 16.87 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -50.12 -75.16 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -78.68 18.14 0.62 Allowed 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.718 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' HB2' ' H ' ' A' ' 11' ' ' GLN . 30.9 t70 -56.48 -36.2 68.83 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.618 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 1.4 m -79.15 -168.75 1.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.819 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.81 146.84 35.67 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.259 0.836 . . . . 0.0 113.259 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.57 104.34 0.06 Allowed 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.401 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.34 -30.7 2.5 Favored Glycine 0 N--CA 1.495 2.612 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 2.8 m -82.87 157.48 23.08 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 122.184 0.993 . . . . 0.0 112.466 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.0 m -133.65 160.14 42.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 104.171 -2.529 . . . . 0.0 104.171 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.0 t -121.5 140.61 51.97 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.941 -0.704 . . . . 0.0 112.764 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.92 174.32 47.71 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 113.934 -1.485 . . . . 0.0 110.141 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -52.92 -30.42 48.08 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.091 1.861 . . . . 0.0 110.651 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -61.35 -9.55 5.53 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 113.662 -1.608 . . . . 0.0 114.196 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.18 17.79 76.1 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 111.9 -0.48 . . . . 0.0 111.9 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -117.19 144.0 45.24 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 114.967 -0.617 . . . . 0.0 109.794 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.0 m -74.12 146.74 43.31 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 124.311 1.007 . . . . 0.0 112.628 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 115.937 -2.59 . . . . 0.0 109.702 179.714 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 49.0 t -72.45 131.79 84.41 Favored Pre-proline 0 N--CA 1.496 1.83 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.397 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_endo -67.0 137.57 44.98 Favored 'Trans proline' 0 N--CA 1.488 1.169 0 C-N-CA 121.722 1.615 . . . . 0.0 110.567 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -53.59 120.62 6.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 123.951 0.782 . . . . 0.0 112.862 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.4 tt -172.86 87.09 0.07 Allowed 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.47 95.27 1.36 Allowed 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.92 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.3 ptm -131.86 158.53 41.1 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.749 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.59 142.88 42.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.003 0.815 . . . . 0.0 108.964 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . 2.1 p -123.79 128.59 49.76 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 124.252 0.97 . . . . 0.0 112.128 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -82.71 -32.32 28.07 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.862 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -138.44 170.57 15.79 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.316 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -57.74 -60.48 3.63 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.023 0.44 . . . . 0.0 111.388 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.2 p -68.36 6.97 0.67 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -51.63 -45.85 63.43 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 123.47 0.481 . . . . 0.0 111.385 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -81.68 -177.14 6.42 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.487 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.92 147.46 12.19 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.044 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.34 106.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.647 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.85 -26.6 2.87 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.8 m -84.92 172.44 11.37 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.118 0.961 . . . . 0.0 111.973 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 m -141.67 165.92 17.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.887 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 t -92.98 108.91 20.37 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.207 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.16 115.86 6.18 Favored Glycine 0 N--CA 1.49 2.239 0 CA-C-O 118.23 -1.317 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.33 85.78 0.06 OUTLIER 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 123.038 2.492 . . . . 0.0 112.19 -173.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.3 p30 177.98 -35.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.11 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.84 -42.71 0.62 Allowed Glycine 0 N--CA 1.482 1.75 0 O-C-N 123.986 0.804 . . . . 0.0 112.982 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -92.97 149.98 20.86 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.484 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 2.3 m -63.82 172.42 2.24 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 124.844 1.34 . . . . 0.0 113.019 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.469 0 CA-C-O 115.881 -2.621 . . . . 0.0 110.829 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.419 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 t -93.24 118.97 67.84 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 114.919 -0.641 . . . . 0.0 110.2 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -68.31 173.08 10.14 Favored 'Trans proline' 0 N--CA 1.487 1.136 0 C-N-CA 122.123 1.882 . . . . 0.0 110.541 171.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -42.12 148.84 0.17 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.31 109.97 1.55 Allowed 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.882 -1.053 . . . . 0.0 108.859 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.56 72.5 4.1 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 124.275 0.985 . . . . 0.0 109.929 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 57.1 mtp -138.54 139.32 38.65 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.35 133.91 51.48 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 123.817 0.698 . . . . 0.0 112.604 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.58 177.9 4.65 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.967 -1.47 . . . . 0.0 109.645 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -149.8 -26.78 0.26 Allowed 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.098 -1.41 . . . . 0.0 108.205 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -155.17 167.29 30.84 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.01 -67.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.019 0.438 . . . . 0.0 110.001 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.0 p -67.36 -3.16 7.42 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.808 -1.087 . . . . 0.0 113.286 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -52.21 -38.63 58.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 123.515 0.509 . . . . 0.0 112.128 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.6 m -97.27 -164.63 1.17 Allowed 'General case' 0 N--CA 1.484 1.272 0 O-C-N 124.651 1.219 . . . . 0.0 111.091 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.3 142.16 10.55 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 124.02 0.825 . . . . 0.0 111.684 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.1 113.03 0.98 Allowed 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.871 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.28 -21.64 9.24 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.163 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.8 m -79.92 162.95 24.68 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 120.563 0.22 . . . . 0.0 110.971 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.8 m -134.76 154.78 37.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 O-C-N 124.312 1.008 . . . . 0.0 110.066 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.5 t -90.35 107.11 18.94 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.747 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -75.31 170.22 54.49 Favored Glycine 0 N--CA 1.484 1.86 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.927 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.98 -36.26 99.18 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.416 2.078 . . . . 0.0 111.22 177.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -65.99 -1.55 3.17 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.843 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 75.44 13.85 82.51 Favored Glycine 0 N--CA 1.482 1.711 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.951 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -110.35 149.24 30.5 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.178 0.513 . . . . 0.0 111.605 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.0 m -62.54 165.96 5.74 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.153 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.84 0 CA-C-O 117.669 -1.629 . . . . 0.0 112.868 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.4 t -139.89 91.06 10.54 Favored Pre-proline 0 N--CA 1.491 1.599 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.246 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -64.09 -176.03 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.577 2.185 . . . . 0.0 113.235 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -48.1 119.42 2.9 Favored 'General case' 0 N--CA 1.496 1.853 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.106 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.501 HD13 ' H ' ' A' ' 6' ' ' LEU . 0.1 OUTLIER -70.85 132.86 45.91 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 114.761 -1.108 . . . . 0.0 113.303 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.501 ' H ' HD13 ' A' ' 5' ' ' LEU . 0.5 OUTLIER 179.01 44.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.378 -1.283 . . . . 0.0 108.127 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.75 139.64 27.99 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.48 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.01 147.46 32.87 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 114.352 -1.294 . . . . 0.0 110.176 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.2 p -138.0 141.6 40.44 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.8 18.02 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.126 -1.397 . . . . 0.0 109.186 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -139.52 174.51 10.44 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.754 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.68 -53.11 61.35 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.282 0.563 . . . . 0.0 109.749 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 p -57.49 -11.83 2.24 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.182 -1.372 . . . . 0.0 114.184 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -49.0 -47.14 44.59 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 123.894 0.746 . . . . 0.0 112.223 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.5 m -90.82 177.91 6.19 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.487 1.117 . . . . 0.0 110.338 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.5 155.44 40.58 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.921 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -48.63 112.31 0.58 Allowed 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.662 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 134.7 -34.59 2.32 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.0 m -90.6 155.49 18.82 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.719 0.771 . . . . 0.0 111.235 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.1 m -128.96 167.65 23.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 CA-C-N 113.222 -1.808 . . . . 0.0 107.506 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 t -111.19 111.68 22.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 123.674 0.609 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.73 147.81 26.91 Favored Glycine 0 CA--C 1.541 1.705 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -52.45 -21.49 14.06 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.315 2.01 . . . . 0.0 113.145 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.416 ' H ' HD22 ' A' ' 24' ' ' ASN . 1.6 p30 -56.43 -27.08 55.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 124.132 0.895 . . . . 0.0 113.26 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 122.54 -38.96 2.4 Favored Glycine 0 N--CA 1.481 1.676 0 O-C-N 123.947 0.779 . . . . 0.0 111.205 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -93.59 158.08 15.87 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 115.233 -0.484 . . . . 0.0 111.301 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.422 ' HB2' HD11 ' A' ' 5' ' ' LEU . 1.7 m -68.89 178.28 2.25 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.747 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 179.833 . . . . . . . . 0 0 . 1 stop_ save_