data_2i5o_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 2i5o _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 ' 10' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.422 -1.866 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.04 125.65 13.37 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 121.19 1.26 . . . . 0.0 112.147 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -74.4 111.59 9.74 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.728 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.15 -23.23 33.42 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 124.085 0.954 . . . . 0.0 113.168 -175.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -82.39 -18.18 42.89 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.3 p -135.07 -27.88 1.21 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.53 -5.24 64.62 Favored Glycine 0 C--N 1.308 -0.973 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.274 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.1 m -76.79 138.12 39.68 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.0 mt -79.04 106.08 10.82 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -108.52 131.4 21.79 Favored Pre-proline 0 C--N 1.288 -2.066 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.636 -174.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.13 127.99 25.55 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.838 2.359 . . . . 0.0 111.212 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.4 p -48.94 -38.53 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 125.464 1.505 . . . . 0.0 112.673 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 38.2 p90 -73.16 -17.17 61.41 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -98.31 -3.43 37.21 Favored 'General case' 0 CA--C 1.489 -1.4 0 O-C-N 122.302 -0.249 . . . . 0.0 110.587 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.42 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.4 mmt -52.41 -49.8 83.41 Favored Pre-proline 0 C--O 1.211 -0.96 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' MET . 9.4 Cg_endo -57.1 -49.07 15.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 121.546 1.497 . . . . 0.0 111.035 177.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -58.01 -50.33 73.77 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 124.616 1.167 . . . . 0.0 112.518 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -68.42 -41.99 79.58 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.292 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 89.5 mmm -66.36 -33.58 76.05 Favored 'General case' 0 CA--C 1.491 -1.298 0 O-C-N 121.883 -0.511 . . . . 0.0 110.847 177.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -67.69 -31.3 71.17 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.413 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -67.81 -40.26 83.86 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.728 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -66.47 -32.2 73.42 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.957 175.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -59.65 -57.96 10.67 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.99 -48.49 78.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.059 0.457 . . . . 0.0 111.234 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.4 tp . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.184 -177.638 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.8 130.39 21.77 Favored 'Trans proline' 0 N--CA 1.435 -1.951 0 C-N-CA 121.403 1.402 . . . . 0.0 111.287 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.5 t -73.5 123.17 23.39 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.669 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -56.52 -35.86 68.53 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 123.848 0.859 . . . . 0.0 110.879 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -83.19 -9.31 59.24 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -142.75 -23.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.41 -1.52 76.42 Favored Glycine 0 C--N 1.312 -0.783 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.37 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.5 m -81.03 138.42 36.01 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.45 109.91 10.56 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.2 t -112.47 127.89 26.26 Favored Pre-proline 0 C--N 1.294 -1.839 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.0 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.3 133.6 36.65 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.318 2.678 . . . . 0.0 111.676 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.2 p -48.96 -35.87 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 124.756 1.223 . . . . 0.0 112.985 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -79.52 -12.35 59.87 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -103.59 -4.8 23.39 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 121.742 -0.598 . . . . 0.0 110.564 177.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.4 mmt -50.1 -55.53 23.99 Favored Pre-proline 0 N--CA 1.467 0.399 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.78 -47.36 27.63 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.857 1.705 . . . . 0.0 111.247 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.15 -51.78 67.95 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 124.381 1.072 . . . . 0.0 112.259 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -67.19 -43.51 81.96 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.771 -178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.5 mmm -68.17 -28.13 67.02 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 121.897 -0.502 . . . . 0.0 111.149 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -67.79 -37.93 82.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -62.02 -47.41 84.88 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -63.68 -39.26 93.89 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.854 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.47 -56.74 17.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.896 0.748 . . . . 0.0 109.683 -175.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.89 -38.73 86.83 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.447 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 C--O 1.238 0.48 0 CA-C-O 121.255 0.55 . . . . 0.0 111.118 -178.314 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.432 -1.366 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.19 122.77 9.32 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 121.748 1.632 . . . . 0.0 112.866 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 14.8 t -65.85 120.62 13.37 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 123.887 0.875 . . . . 0.0 109.699 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.85 -22.73 62.68 Favored 'General case' 0 C--N 1.301 -1.527 0 C-N-CA 123.397 0.679 . . . . 0.0 112.819 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.67 -9.32 38.27 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.8 -10.94 0.9 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.59 -5.19 75.31 Favored Glycine 0 C--N 1.312 -0.788 0 C-N-CA 121.017 -0.611 . . . . 0.0 113.178 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.1 m -79.83 138.81 37.31 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 122.487 0.315 . . . . 0.0 110.294 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.5 mt -78.17 100.88 6.79 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.601 0.715 . . . . 0.0 109.195 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.3 t -104.67 133.34 20.23 Favored Pre-proline 0 C--N 1.282 -2.357 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.54 -174.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.19 128.33 28.68 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.367 2.045 . . . . 0.0 110.223 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.23 -35.21 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 C-N-CA 124.467 1.107 . . . . 0.0 112.627 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -75.27 -10.6 59.61 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -102.25 -9.1 20.72 Favored 'General case' 0 CA--C 1.503 -0.863 0 C-N-CA 122.829 0.451 . . . . 0.0 110.203 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.3 mmt -50.05 -55.14 26.4 Favored Pre-proline 0 N--CA 1.472 0.634 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -54.25 -50.04 14.91 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 121.998 1.799 . . . . 0.0 111.616 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -62.4 -46.42 88.69 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 124.226 1.01 . . . . 0.0 112.753 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -66.13 -46.4 77.65 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 123.084 0.554 . . . . 0.0 111.187 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.7 mmm -66.26 -29.5 69.75 Favored 'General case' 0 C--N 1.311 -1.08 0 O-C-N 121.878 -0.514 . . . . 0.0 110.528 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.39 -32.68 73.75 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.839 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -66.49 -45.58 79.15 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.674 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -66.36 -33.31 75.45 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.426 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -62.65 -58.43 7.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.58 -28.9 68.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.743 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.264 0.554 . . . . 0.0 110.601 179.034 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.434 -1.267 0 CA-C-O 120.627 0.251 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.54 124.63 12.67 Favored 'Trans proline' 0 N--CA 1.44 -1.664 0 C-N-CA 121.76 1.64 . . . . 0.0 111.316 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -70.84 117.41 12.31 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.43 -30.72 67.12 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -79.97 -8.89 59.58 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -142.33 -26.03 0.64 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.44 -9.33 69.29 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.945 -0.645 . . . . 0.0 113.045 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -74.88 138.93 42.78 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.06 103.37 7.95 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 49.3 t -108.0 133.61 20.43 Favored Pre-proline 0 C--N 1.294 -1.814 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.307 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.03 137.85 82.93 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.932 2.421 . . . . 0.0 112.112 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.5 p -50.73 -36.44 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 124.745 1.218 . . . . 0.0 112.399 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.8 p90 -71.23 -22.0 62.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.0 -11.31 36.37 Favored 'General case' 0 CA--C 1.491 -1.312 0 O-C-N 122.423 -0.173 . . . . 0.0 110.67 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.257 9.2 mmt -49.39 -56.34 16.88 Favored Pre-proline 0 C--O 1.219 -0.519 0 N-CA-C 116.254 1.946 . . . . 0.0 116.254 -174.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.67 -53.53 5.96 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.872 1.715 . . . . 0.0 111.511 179.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -55.37 -49.9 71.08 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.236 1.014 . . . . 0.0 112.186 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -66.9 -44.6 80.4 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.334 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 67.3 mtp -65.22 -36.18 83.37 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.766 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -70.96 -30.41 66.69 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.153 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 93.8 t80 -64.49 -40.44 95.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -63.86 -39.63 94.67 Favored 'General case' 0 C--O 1.202 -1.441 0 C-N-CA 120.276 -0.569 . . . . 0.0 110.151 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -56.7 -49.45 75.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 123.124 0.265 . . . . 0.0 111.605 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.24 -40.57 96.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.154 0.502 . . . . 0.0 110.286 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp . . . . . 0 C--N 1.319 -0.725 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 -178.76 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.433 -1.319 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -70.74 131.83 20.61 Favored 'Trans proline' 0 N--CA 1.434 -2.009 0 C-N-CA 121.19 1.26 . . . . 0.0 111.493 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.3 t -74.03 116.42 14.63 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.304 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.34 -25.38 34.54 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -88.68 -9.91 50.38 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.9 p -142.57 -15.63 0.73 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.89 -1.87 86.98 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.704 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.1 m -82.27 134.33 35.28 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 122.522 -0.399 . . . . 0.0 110.318 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -77.9 100.99 6.6 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.4 t -104.9 133.82 19.96 Favored Pre-proline 0 C--N 1.285 -2.206 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.174 -175.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -49.99 128.99 23.52 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 122.893 2.396 . . . . 0.0 111.13 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.9 p -48.52 -34.48 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.193 0 C-N-CA 124.948 1.299 . . . . 0.0 112.594 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 31.4 p90 -74.78 -16.93 60.7 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -98.74 -6.71 28.93 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 121.932 -0.48 . . . . 0.0 110.354 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.265 7.3 mmt -51.27 -57.55 13.69 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.97 -50.53 13.05 Favored 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.072 1.848 . . . . 0.0 111.325 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -54.57 -58.1 8.82 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.635 1.174 . . . . 0.0 113.177 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -63.28 -46.09 88.41 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.51 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.1 mmm -64.79 -36.35 84.05 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.257 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -69.61 -29.08 66.5 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.386 0.613 . . . . 0.0 110.122 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -63.55 -45.47 90.36 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.338 -0.846 . . . . 0.0 108.909 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -63.47 -41.69 98.6 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.191 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -54.51 -58.27 8.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 123.267 0.354 . . . . 0.0 111.633 -178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.45 -35.93 80.19 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.495 0.497 . . . . 0.0 111.604 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.481 0.658 . . . . 0.0 110.907 -178.605 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.5 m . . . . . 0 N--CA 1.422 -1.853 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.54 130.71 25.74 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 C-N-CA 121.578 1.519 . . . . 0.0 111.303 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 t -73.93 123.86 25.07 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.441 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -58.83 -33.49 70.46 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.631 0.729 . . . . 0.0 110.616 -176.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -83.22 -9.26 59.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -174.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 p -142.04 -20.29 0.72 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.04 1.21 88.8 Favored Glycine 0 C--N 1.31 -0.894 0 C-N-CA 121.134 -0.555 . . . . 0.0 112.44 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.7 m -85.99 138.93 31.62 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 122.458 -0.437 . . . . 0.0 110.246 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.9 mt -75.56 110.5 10.0 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 122.943 0.497 . . . . 0.0 110.017 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 43.1 t -111.13 132.38 21.74 Favored Pre-proline 0 C--N 1.285 -2.212 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.277 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -54.57 130.89 42.53 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.736 2.291 . . . . 0.0 109.933 173.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 p -46.95 -37.89 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.16 0.984 . . . . 0.0 113.463 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.4 p90 -77.26 -12.64 59.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.48 -6.52 33.58 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.5 mmt -51.41 -55.72 26.68 Favored Pre-proline 0 C--O 1.211 -0.928 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -53.18 -49.46 17.43 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 121.694 1.596 . . . . 0.0 111.087 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -53.57 -58.31 7.64 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.973 1.309 . . . . 0.0 111.539 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -65.81 -42.77 90.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.304 -175.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 93.9 mmm -70.12 -27.37 64.53 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.158 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.8 -36.68 75.86 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.89 -45.03 94.43 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.115 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -62.84 -41.08 99.2 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.695 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -57.79 -57.11 14.2 Favored 'General case' 0 N--CA 1.444 -0.731 0 O-C-N 123.578 0.549 . . . . 0.0 109.683 -174.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.18 93.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.173 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 110.812 -179.654 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.431 -1.387 0 CA-C-O 120.634 0.254 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.98 129.38 20.59 Favored 'Trans proline' 0 N--CA 1.441 -1.604 0 C-N-CA 121.562 1.508 . . . . 0.0 110.642 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.3 t -72.83 114.91 11.49 Favored 'General case' 0 C--N 1.282 -2.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -52.04 -33.93 40.97 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.788 0.835 . . . . 0.0 111.461 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -80.99 -9.71 59.81 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -175.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.0 p -143.31 -21.17 0.62 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.34 -4.58 80.48 Favored Glycine 0 C--N 1.314 -0.688 0 C-N-CA 121.621 -0.323 . . . . 0.0 112.759 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -80.54 141.68 34.87 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.413 -0.463 . . . . 0.0 109.825 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 114.34 16.15 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.465 0.65 . . . . 0.0 109.703 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.9 t -115.0 133.06 22.71 Favored Pre-proline 0 C--N 1.29 -1.983 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.084 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.12 136.77 76.98 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.258 1.972 . . . . 0.0 110.157 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.6 p -49.52 -34.53 8.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 C-N-CA 124.003 0.921 . . . . 0.0 112.098 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -79.92 -10.28 59.76 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.45 -13.18 20.69 Favored 'General case' 0 CA--C 1.494 -1.189 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 7.3 mmt -50.93 -54.02 41.57 Favored Pre-proline 0 C--O 1.212 -0.877 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.7 -49.37 16.98 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 121.561 1.507 . . . . 0.0 111.428 176.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -54.14 -55.31 28.98 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 124.698 1.199 . . . . 0.0 111.453 177.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -68.75 -41.3 79.11 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.804 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 13.6 mmt -67.01 -34.82 78.58 Favored 'General case' 0 CA--C 1.485 -1.556 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.094 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.35 -34.44 77.72 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -62.05 -48.64 79.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.668 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -64.29 -42.03 96.58 Favored 'General case' 0 C--O 1.193 -1.901 0 C-N-CA 119.901 -0.719 . . . . 0.0 110.464 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -57.44 -49.02 77.57 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 122.666 0.386 . . . . 0.0 111.358 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.17 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.904 0.383 . . . . 0.0 110.326 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 tp . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.723 178.923 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.09 130.28 18.67 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.704 1.603 . . . . 0.0 112.082 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.7 t -74.16 117.31 15.81 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.756 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -52.22 -33.84 42.98 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.079 0.552 . . . . 0.0 112.446 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -82.12 -8.91 59.67 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 p -141.92 -25.15 0.68 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.24 -6.3 75.46 Favored Glycine 0 C--O 1.22 -0.729 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.092 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.3 m -79.99 139.06 37.16 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.7 mt -76.8 114.79 15.96 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.414 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 53.1 t -121.41 135.19 24.84 Favored Pre-proline 0 C--N 1.3 -1.565 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.148 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.17 130.14 36.77 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.889 2.392 . . . . 0.0 111.451 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.8 p -50.17 -34.93 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 124.19 0.996 . . . . 0.0 113.092 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -77.14 -17.89 58.28 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -100.74 -3.61 29.76 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.414 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -49.96 -57.92 11.05 Favored Pre-proline 0 N--CA 1.474 0.733 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -56.24 -43.18 58.56 Favored 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 121.89 1.727 . . . . 0.0 111.535 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -56.76 -55.68 31.11 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.882 1.273 . . . . 0.0 110.879 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.15 -44.66 91.46 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.131 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.516 ' O ' ' HD1' ' A' ' 32' ' ' PHE . 8.1 mmt -61.76 -37.09 83.0 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.586 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.93 -33.16 75.19 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 123.583 0.552 . . . . 0.0 109.692 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -62.23 -45.24 94.23 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.822 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -62.15 -41.98 98.82 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.266 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.516 ' HD1' ' O ' ' A' ' 28' ' ' MET . 17.1 m-85 -59.45 -58.04 10.35 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.98 69.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.896 0.379 . . . . 0.0 111.261 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.368 0.604 . . . . 0.0 110.229 177.255 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.435 -1.196 0 CA-C-O 120.677 0.275 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.22 124.79 12.12 Favored 'Trans proline' 0 N--CA 1.431 -2.178 0 C-N-CA 121.794 1.663 . . . . 0.0 111.954 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.8 t -71.71 117.35 13.18 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.267 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -57.47 -31.33 65.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 123.715 0.634 . . . . 0.0 110.76 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -81.94 -9.54 59.55 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.4 p -143.64 -21.18 0.59 Allowed 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 177.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.77 -2.36 76.5 Favored Glycine 0 C--N 1.313 -0.745 0 C-N-CA 121.496 -0.383 . . . . 0.0 113.384 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.82 140.43 34.19 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.3 mt -81.09 102.47 10.26 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.412 ' HB ' ' HE2' ' A' ' 24' ' ' MET . 31.9 t -100.73 132.35 22.35 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.468 -173.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.92 127.0 23.82 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.548 2.165 . . . . 0.0 110.734 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 p -50.64 -32.34 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 125.221 1.408 . . . . 0.0 113.031 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -74.12 -24.02 59.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 178.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -101.67 -0.48 34.54 Favored 'General case' 0 CA--C 1.492 -1.253 0 O-C-N 121.824 -0.547 . . . . 0.0 110.5 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.439 ' O ' ' HG3' ' A' ' 28' ' ' MET . 0.2 OUTLIER -51.77 -52.68 58.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 179.006 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -59.17 -44.84 31.2 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 121.53 1.486 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.45 -48.42 79.22 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 124.655 1.182 . . . . 0.0 111.316 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -65.46 -42.15 92.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.942 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.439 ' HG3' ' O ' ' A' ' 24' ' ' MET . 49.2 mtp -69.04 -29.82 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.768 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.13 -35.17 73.89 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -64.9 -45.88 84.04 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.833 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -65.16 -34.64 78.87 Favored 'General case' 0 C--O 1.2 -1.524 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.724 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -59.31 -56.14 25.88 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.58 -38.96 92.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.871 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 tp . . . . . 0 CA--C 1.549 0.912 0 CA-C-O 121.472 0.653 . . . . 0.0 110.922 179.843 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.428 -1.558 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.09 125.06 11.56 Favored 'Trans proline' 0 N--CA 1.439 -1.706 0 C-N-CA 121.628 1.552 . . . . 0.0 111.983 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.9 t -72.55 117.55 14.36 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.918 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -55.24 -27.6 47.4 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 124.417 1.087 . . . . 0.0 113.22 -175.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -86.1 -9.56 56.47 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -140.83 -27.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -177.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.22 -7.29 75.83 Favored Glycine 0 C--N 1.308 -1.012 0 C-N-CA 121.273 -0.489 . . . . 0.0 111.945 -178.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 m -77.41 138.0 39.03 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.19 111.73 13.12 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.8 t -113.07 130.54 23.47 Favored Pre-proline 0 C--N 1.283 -2.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.869 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.64 128.88 31.25 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.487 2.125 . . . . 0.0 110.526 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.7 p -48.55 -34.35 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.403 0 C-N-CA 125.479 1.512 . . . . 0.0 112.676 -175.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -77.61 -15.38 59.25 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -100.12 -4.15 30.32 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 7.4 mmt -51.05 -58.27 10.97 Favored Pre-proline 0 C--O 1.208 -1.131 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.2 -46.17 35.83 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.124 1.883 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.93 -51.7 68.94 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 125.116 1.367 . . . . 0.0 112.152 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -64.55 -33.93 77.05 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.548 0.689 . . . . 0.0 109.804 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -36.46 84.32 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.413 175.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.8 -34.7 78.4 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.584 0.552 . . . . 0.0 109.882 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.52 -50.58 70.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.607 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -65.18 -36.69 84.99 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.307 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -56.48 -56.87 15.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.46 88.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.735 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.591 -176.832 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.427 -1.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.07 124.82 12.69 Favored 'Trans proline' 0 N--CA 1.436 -1.87 0 C-N-CA 121.084 1.189 . . . . 0.0 110.158 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.4 t -74.19 110.67 8.67 Favored 'General case' 0 C--N 1.275 -2.652 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.169 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -46.88 -34.03 5.06 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -80.9 -8.99 59.87 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.7 p -142.67 -23.22 0.65 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.88 -7.74 76.67 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.074 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.3 m -78.89 138.69 38.24 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.52 103.85 7.7 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.8 t -106.1 129.02 25.23 Favored Pre-proline 0 C--N 1.283 -2.312 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.353 -175.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.45 130.88 26.54 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.97 2.447 . . . . 0.0 111.291 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.0 p -51.96 -37.64 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.624 -175.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.8 p90 -75.85 -13.24 60.27 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -101.11 -1.12 34.87 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.256 8.6 mmt -52.53 -52.57 62.43 Favored Pre-proline 0 C--O 1.216 -0.701 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -50.85 -53.12 7.69 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.875 1.717 . . . . 0.0 111.161 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.28 -55.85 24.22 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 124.915 1.286 . . . . 0.0 112.077 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -67.54 -41.87 83.59 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.745 -176.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.3 mmm -69.59 -29.27 66.76 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.665 -0.647 . . . . 0.0 111.276 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.89 -29.87 67.17 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -64.9 -47.12 78.95 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.416 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.4 m-70 -65.37 -38.87 91.36 Favored 'General case' 0 C--O 1.195 -1.764 0 C-N-CA 119.59 -0.844 . . . . 0.0 110.718 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -58.72 -53.29 59.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.722 0.237 . . . . 0.0 111.601 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.62 -40.95 96.66 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.968 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.1 tp . . . . . 0 CA--C 1.537 0.479 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.456 -179.075 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.6 m . . . . . 0 N--CA 1.428 -1.562 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.97 130.62 16.93 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 120.973 1.116 . . . . 0.0 110.21 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.3 t -72.55 110.99 7.32 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.75 -22.73 15.02 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -81.51 -26.41 35.15 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -128.63 -19.14 3.79 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.94 -3.18 85.94 Favored Glycine 0 C--N 1.306 -1.101 0 C-N-CA 121.347 -0.454 . . . . 0.0 112.951 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -79.71 144.68 33.46 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.61 115.01 21.39 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.355 0.598 . . . . 0.0 109.948 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.653 ' HB ' ' SD ' ' A' ' 24' ' ' MET . 28.4 t -113.49 136.19 21.92 Favored Pre-proline 0 C--N 1.291 -1.95 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.482 -177.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -59.26 141.07 97.36 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.021 1.814 . . . . 0.0 110.61 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.5 p -53.83 -34.44 25.26 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 C-N-CA 123.781 0.833 . . . . 0.0 111.361 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -77.6 -19.3 55.79 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -97.61 -7.45 31.09 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.977 -0.452 . . . . 0.0 110.724 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.653 ' SD ' ' HB ' ' A' ' 19' ' ' VAL . 87.7 mmm -51.15 -55.77 25.55 Favored Pre-proline 0 C--N 1.316 -0.854 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -55.49 -45.91 36.16 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.944 1.763 . . . . 0.0 111.129 178.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.63 -53.83 49.62 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 125.327 1.451 . . . . 0.0 110.055 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -66.79 -40.92 88.32 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.542 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 97.3 mmm -69.06 -28.05 66.19 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.836 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -72.59 -30.03 64.02 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.724 0.774 . . . . 0.0 108.925 178.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.9 -47.08 79.06 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.235 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -66.91 -33.33 75.35 Favored 'General case' 0 C--O 1.191 -1.976 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.044 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -59.62 -51.54 69.38 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -176.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.83 82.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.095 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 tp . . . . . 0 CA--C 1.552 1.027 0 C-N-CA 123.449 0.699 . . . . 0.0 111.64 -179.274 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.76 124.22 11.66 Favored 'Trans proline' 0 N--CA 1.438 -1.754 0 C-N-CA 121.367 1.378 . . . . 0.0 111.335 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.405 ' HB2' ' CG2' ' A' ' 19' ' ' VAL . 43.7 t -74.76 112.83 11.36 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.93 178.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.45 -30.17 60.02 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 124.097 0.959 . . . . 0.0 111.664 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -78.71 -9.67 59.49 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.4 p -143.53 -22.89 0.6 Allowed 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.84 7.61 83.78 Favored Glycine 0 C--N 1.305 -1.144 0 C-N-CA 121.601 -0.333 . . . . 0.0 113.117 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -89.21 144.6 25.99 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.07 106.3 13.86 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.405 ' CG2' ' HB2' ' A' ' 12' ' ' CYS . 46.8 t -92.12 133.67 29.85 Favored Pre-proline 0 C--N 1.279 -2.483 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.742 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.95 126.87 18.16 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 122.144 1.896 . . . . 0.0 109.327 174.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.1 p -47.01 -40.0 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.591 0 C-N-CA 124.488 1.115 . . . . 0.0 113.457 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.4 p90 -66.77 -28.59 68.52 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -106.22 4.78 29.24 Favored 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 121.557 -0.714 . . . . 0.0 111.166 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -53.11 58.91 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.5 -41.58 39.42 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 121.651 1.567 . . . . 0.0 111.127 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -58.19 -48.94 78.77 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.67 1.188 . . . . 0.0 110.618 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -65.28 -42.4 93.2 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.588 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.21 -35.53 80.61 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.001 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -66.48 -34.73 78.59 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 123.764 0.665 . . . . 0.0 110.471 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -63.07 -42.77 99.75 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -63.55 -39.75 95.22 Favored 'General case' 0 C--O 1.194 -1.859 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.534 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.24 -50.91 72.18 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 120.411 0.148 . . . . 0.0 111.31 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.14 95.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.255 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp . . . . . 0 N--CA 1.465 0.297 0 C-N-CA 124.013 0.925 . . . . 0.0 111.074 -179.568 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.439 -0.993 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.27 124.95 11.36 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 121.091 1.194 . . . . 0.0 110.885 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.2 t -74.86 111.9 10.54 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.222 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -50.01 -33.27 17.51 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.435 1.094 . . . . 0.0 112.572 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -79.35 -9.4 59.58 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.9 p -142.95 -20.99 0.64 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.46 0.33 86.55 Favored Glycine 0 C--O 1.217 -0.934 0 C-N-CA 121.707 -0.282 . . . . 0.0 112.399 -177.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -82.74 139.43 33.62 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.53 106.79 10.72 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 54.3 t -100.81 132.47 22.12 Favored Pre-proline 0 C--N 1.293 -1.873 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.818 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.7 133.75 60.0 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.003 2.468 . . . . 0.0 110.772 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.0 p -52.97 -35.42 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.139 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.0 p90 -74.57 -23.53 58.77 Favored 'General case' 0 CA--C 1.55 0.981 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -105.51 3.23 29.2 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.263 -0.898 . . . . 0.0 110.75 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.96 -54.64 35.17 Favored Pre-proline 0 CA--C 1.563 1.448 0 C-N-CA 123.713 0.805 . . . . 0.0 111.895 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.07 -43.02 32.14 Favored 'Trans proline' 0 C--N 1.385 2.484 0 C-N-CA 121.904 1.736 . . . . 0.0 111.698 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -54.96 -51.87 64.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.484 1.113 . . . . 0.0 110.693 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.9 t60 -66.23 -40.42 90.24 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.863 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.2 mmm -68.26 -29.08 67.79 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.859 177.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -72.18 -31.47 65.95 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -63.77 -48.72 75.82 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.416 176.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -64.41 -37.16 86.56 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.182 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -63.07 -55.21 27.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.55 -34.16 75.09 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 123.162 0.585 . . . . 0.0 111.01 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 tp . . . . . 0 C--N 1.321 -0.652 0 O-C-N 123.518 0.511 . . . . 0.0 110.368 -179.709 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.416 HG21 ' SD ' ' A' ' 24' ' ' MET . 13.5 m . . . . . 0 N--CA 1.437 -1.099 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -66.91 122.15 9.45 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 121.804 1.669 . . . . 0.0 111.42 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.2 t -74.27 115.06 13.35 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.154 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.56 -35.8 42.59 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.739 0.816 . . . . 0.0 112.381 -177.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -76.36 -9.31 58.55 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -173.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.1 p -143.42 -25.7 0.58 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.5 -1.04 75.32 Favored Glycine 0 C--N 1.312 -0.764 0 C-N-CA 121.592 -0.337 . . . . 0.0 113.125 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -80.45 137.91 36.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.279 0.54 . . . . 0.0 109.746 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.33 103.79 6.52 Favored 'General case' 0 CA--C 1.498 -1.039 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.9 t -98.45 134.94 21.38 Favored Pre-proline 0 C--N 1.281 -2.37 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.932 -176.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.09 128.56 27.51 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.612 2.208 . . . . 0.0 109.767 174.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -50.64 -37.95 16.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 124.888 1.275 . . . . 0.0 112.53 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -69.97 -30.37 67.7 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -91.8 -0.12 57.51 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.826 -0.546 . . . . 0.0 111.185 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.416 ' SD ' HG21 ' A' ' 10' ' ' VAL 0.256 0.0 OUTLIER -51.47 -58.48 10.63 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.334 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.01 -45.22 37.55 Favored 'Trans proline' 0 C--N 1.369 1.637 0 C-N-CA 121.948 1.765 . . . . 0.0 111.157 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -54.03 -53.27 55.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.326 1.05 . . . . 0.0 110.858 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -65.99 -38.9 89.7 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 124.182 0.993 . . . . 0.0 110.872 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.5 mtp -68.03 -29.67 68.71 Favored 'General case' 0 C--O 1.203 -1.359 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.402 176.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.15 -32.16 70.01 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -62.99 -45.87 90.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.106 174.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -65.58 -35.6 81.29 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.874 -0.73 . . . . 0.0 109.957 176.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -60.06 -56.35 22.7 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -176.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.17 90.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.995 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 tp . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 -179.395 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.923 0 CA-C-O 120.918 0.39 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.15 52.87 2.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.486 0.66 . . . . 0.0 111.229 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -101.1 18.01 20.9 Favored 'General case' 0 CA--C 1.48 -1.732 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.199 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -93.7 109.69 21.34 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.6 m -102.36 144.9 29.53 Favored Pre-proline 0 C--N 1.282 -2.359 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.04 125.65 13.37 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 121.19 1.26 . . . . 0.0 112.147 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -74.4 111.59 9.74 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.728 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.15 -23.23 33.42 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 124.085 0.954 . . . . 0.0 113.168 -175.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -82.39 -18.18 42.89 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.3 p -135.07 -27.88 1.21 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.53 -5.24 64.62 Favored Glycine 0 C--N 1.308 -0.973 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.274 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.1 m -76.79 138.12 39.68 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.0 mt -79.04 106.08 10.82 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -108.52 131.4 21.79 Favored Pre-proline 0 C--N 1.288 -2.066 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.636 -174.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.13 127.99 25.55 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.838 2.359 . . . . 0.0 111.212 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.4 p -48.94 -38.53 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 125.464 1.505 . . . . 0.0 112.673 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 38.2 p90 -73.16 -17.17 61.41 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -98.31 -3.43 37.21 Favored 'General case' 0 CA--C 1.489 -1.4 0 O-C-N 122.302 -0.249 . . . . 0.0 110.587 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.42 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.4 mmt -52.41 -49.8 83.41 Favored Pre-proline 0 C--O 1.211 -0.96 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' MET . 9.4 Cg_endo -57.1 -49.07 15.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 121.546 1.497 . . . . 0.0 111.035 177.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -58.01 -50.33 73.77 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 124.616 1.167 . . . . 0.0 112.518 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -68.42 -41.99 79.58 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.292 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 89.5 mmm -66.36 -33.58 76.05 Favored 'General case' 0 CA--C 1.491 -1.298 0 O-C-N 121.883 -0.511 . . . . 0.0 110.847 177.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -67.69 -31.3 71.17 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.413 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -67.81 -40.26 83.86 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.728 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -66.47 -32.2 73.42 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.957 175.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -59.65 -57.96 10.67 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.99 -48.49 78.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.059 0.457 . . . . 0.0 111.234 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.4 tp -59.73 -46.57 88.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.184 -177.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -85.21 -11.34 55.16 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.79 -34.51 52.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 175.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -70.08 -4.01 19.17 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -178.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -105.06 -1.4 25.69 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.328 177.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.243 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.666 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 71.0 23.19 4.3 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.653 1.181 . . . . 0.0 111.13 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -94.11 16.04 15.63 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -108.91 107.64 18.1 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 169.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.1 m -98.86 142.24 24.27 Favored Pre-proline 0 C--N 1.279 -2.496 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -175.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.8 130.39 21.77 Favored 'Trans proline' 0 N--CA 1.435 -1.951 0 C-N-CA 121.403 1.402 . . . . 0.0 111.287 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.5 t -73.5 123.17 23.39 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.669 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -56.52 -35.86 68.53 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 123.848 0.859 . . . . 0.0 110.879 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -83.19 -9.31 59.24 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -142.75 -23.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.41 -1.52 76.42 Favored Glycine 0 C--N 1.312 -0.783 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.37 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.5 m -81.03 138.42 36.01 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.45 109.91 10.56 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.2 t -112.47 127.89 26.26 Favored Pre-proline 0 C--N 1.294 -1.839 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.0 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.3 133.6 36.65 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.318 2.678 . . . . 0.0 111.676 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.2 p -48.96 -35.87 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 124.756 1.223 . . . . 0.0 112.985 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -79.52 -12.35 59.87 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -103.59 -4.8 23.39 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 121.742 -0.598 . . . . 0.0 110.564 177.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 4.4 mmt -50.1 -55.53 23.99 Favored Pre-proline 0 N--CA 1.467 0.399 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.78 -47.36 27.63 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.857 1.705 . . . . 0.0 111.247 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.15 -51.78 67.95 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 124.381 1.072 . . . . 0.0 112.259 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -67.19 -43.51 81.96 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.771 -178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.5 mmm -68.17 -28.13 67.02 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 121.897 -0.502 . . . . 0.0 111.149 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -67.79 -37.93 82.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -62.02 -47.41 84.88 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -63.68 -39.26 93.89 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.854 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.47 -56.74 17.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.896 0.748 . . . . 0.0 109.683 -175.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.89 -38.73 86.83 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.447 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -64.69 -44.77 89.24 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.255 0.55 . . . . 0.0 111.118 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -82.34 -22.02 35.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.897 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.36 -30.07 69.77 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.087 0.47 . . . . 0.0 109.931 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -59.87 -38.57 82.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.367 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -99.6 -1.14 38.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.076 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.434 -1.264 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.496 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.316 0 CA-C-O 121.155 0.503 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.51 24.22 6.72 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -94.27 16.92 13.75 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.257 0.551 . . . . 0.0 111.532 -172.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -105.49 108.75 20.44 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 168.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.5 m -102.84 142.9 25.51 Favored Pre-proline 0 C--N 1.281 -2.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.0 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.19 122.77 9.32 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 121.748 1.632 . . . . 0.0 112.866 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 14.8 t -65.85 120.62 13.37 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 123.887 0.875 . . . . 0.0 109.699 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.85 -22.73 62.68 Favored 'General case' 0 C--N 1.301 -1.527 0 C-N-CA 123.397 0.679 . . . . 0.0 112.819 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.67 -9.32 38.27 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.8 -10.94 0.9 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.59 -5.19 75.31 Favored Glycine 0 C--N 1.312 -0.788 0 C-N-CA 121.017 -0.611 . . . . 0.0 113.178 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.1 m -79.83 138.81 37.31 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 122.487 0.315 . . . . 0.0 110.294 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.5 mt -78.17 100.88 6.79 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.601 0.715 . . . . 0.0 109.195 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.3 t -104.67 133.34 20.23 Favored Pre-proline 0 C--N 1.282 -2.357 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.54 -174.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.19 128.33 28.68 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.367 2.045 . . . . 0.0 110.223 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.23 -35.21 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 C-N-CA 124.467 1.107 . . . . 0.0 112.627 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -75.27 -10.6 59.61 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -102.25 -9.1 20.72 Favored 'General case' 0 CA--C 1.503 -0.863 0 C-N-CA 122.829 0.451 . . . . 0.0 110.203 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.3 mmt -50.05 -55.14 26.4 Favored Pre-proline 0 N--CA 1.472 0.634 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -54.25 -50.04 14.91 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 121.998 1.799 . . . . 0.0 111.616 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -62.4 -46.42 88.69 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 124.226 1.01 . . . . 0.0 112.753 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -66.13 -46.4 77.65 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 123.084 0.554 . . . . 0.0 111.187 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.7 mmm -66.26 -29.5 69.75 Favored 'General case' 0 C--N 1.311 -1.08 0 O-C-N 121.878 -0.514 . . . . 0.0 110.528 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.39 -32.68 73.75 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.839 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -66.49 -45.58 79.15 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.674 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -66.36 -33.31 75.45 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.426 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 17.2 t80 -62.65 -58.43 7.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -176.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.58 -28.9 68.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.743 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.0 tp -68.08 -44.28 76.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.264 0.554 . . . . 0.0 110.601 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 43.5 mt-10 -98.34 -1.66 41.17 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.403 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 32' ' ' PHE . 21.1 tp -58.46 -22.72 55.6 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 123.343 0.657 . . . . 0.0 111.224 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.75 -19.08 61.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.13 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.646 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 18.1 ptpt -101.68 9.0 41.42 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.259 1.604 0 CA-C-O 118.646 -0.693 . . . . 0.0 109.998 -177.855 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 68.94 -37.98 0.38 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 171.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -94.02 16.1 15.34 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.225 0.536 . . . . 0.0 111.137 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -135.95 108.04 7.2 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -116.56 147.72 40.33 Favored Pre-proline 0 C--N 1.28 -2.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.792 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.54 124.63 12.67 Favored 'Trans proline' 0 N--CA 1.44 -1.664 0 C-N-CA 121.76 1.64 . . . . 0.0 111.316 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -70.84 117.41 12.31 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.43 -30.72 67.12 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -79.97 -8.89 59.58 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -142.33 -26.03 0.64 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.44 -9.33 69.29 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.945 -0.645 . . . . 0.0 113.045 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -74.88 138.93 42.78 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.06 103.37 7.95 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 49.3 t -108.0 133.61 20.43 Favored Pre-proline 0 C--N 1.294 -1.814 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.307 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.03 137.85 82.93 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.932 2.421 . . . . 0.0 112.112 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.5 p -50.73 -36.44 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 124.745 1.218 . . . . 0.0 112.399 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.8 p90 -71.23 -22.0 62.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.0 -11.31 36.37 Favored 'General case' 0 CA--C 1.491 -1.312 0 O-C-N 122.423 -0.173 . . . . 0.0 110.67 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.257 9.2 mmt -49.39 -56.34 16.88 Favored Pre-proline 0 C--O 1.219 -0.519 0 N-CA-C 116.254 1.946 . . . . 0.0 116.254 -174.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.67 -53.53 5.96 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.872 1.715 . . . . 0.0 111.511 179.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -55.37 -49.9 71.08 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.236 1.014 . . . . 0.0 112.186 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -66.9 -44.6 80.4 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.334 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 67.3 mtp -65.22 -36.18 83.37 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.766 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -70.96 -30.41 66.69 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.153 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 93.8 t80 -64.49 -40.44 95.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -63.86 -39.63 94.67 Favored 'General case' 0 C--O 1.202 -1.441 0 C-N-CA 120.276 -0.569 . . . . 0.0 110.151 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -56.7 -49.45 75.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 123.124 0.265 . . . . 0.0 111.605 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.24 -40.57 96.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.154 0.502 . . . . 0.0 110.286 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.17 -42.23 99.37 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.06 -18.05 51.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.695 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.4 tp -76.79 -43.75 35.52 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -69.26 -18.24 63.84 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.727 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.4 pttt 53.23 34.13 16.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.507 1.923 . . . . 0.0 112.289 177.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.3 p . . . . . 0 N--CA 1.414 -2.226 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.458 179.912 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.029 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -108.34 6.67 26.65 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.126 0.489 . . . . 0.0 111.329 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -93.58 55.82 2.28 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-O 123.073 1.416 . . . . 0.0 108.359 176.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -122.91 111.59 16.82 Favored 'General case' 0 N--CA 1.421 -1.902 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 176.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.9 147.12 34.2 Favored Pre-proline 0 C--N 1.28 -2.445 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -176.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -70.74 131.83 20.61 Favored 'Trans proline' 0 N--CA 1.434 -2.009 0 C-N-CA 121.19 1.26 . . . . 0.0 111.493 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.3 t -74.03 116.42 14.63 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.304 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.34 -25.38 34.54 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -88.68 -9.91 50.38 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.9 p -142.57 -15.63 0.73 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.89 -1.87 86.98 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.704 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.1 m -82.27 134.33 35.28 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 122.522 -0.399 . . . . 0.0 110.318 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -77.9 100.99 6.6 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.4 t -104.9 133.82 19.96 Favored Pre-proline 0 C--N 1.285 -2.206 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.174 -175.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -49.99 128.99 23.52 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 122.893 2.396 . . . . 0.0 111.13 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.9 p -48.52 -34.48 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.193 0 C-N-CA 124.948 1.299 . . . . 0.0 112.594 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 31.4 p90 -74.78 -16.93 60.7 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -98.74 -6.71 28.93 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 121.932 -0.48 . . . . 0.0 110.354 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.265 7.3 mmt -51.27 -57.55 13.69 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.97 -50.53 13.05 Favored 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.072 1.848 . . . . 0.0 111.325 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -54.57 -58.1 8.82 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.635 1.174 . . . . 0.0 113.177 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -63.28 -46.09 88.41 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.51 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.1 mmm -64.79 -36.35 84.05 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.257 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -69.61 -29.08 66.5 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.386 0.613 . . . . 0.0 110.122 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -63.55 -45.47 90.36 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.338 -0.846 . . . . 0.0 108.909 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -63.47 -41.69 98.6 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.191 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -54.51 -58.27 8.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 123.267 0.354 . . . . 0.0 111.633 -178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -67.45 -35.93 80.19 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.495 0.497 . . . . 0.0 111.604 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.4 tp -66.98 -49.65 64.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.481 0.658 . . . . 0.0 110.907 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -82.49 -13.56 56.48 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.749 -176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 62.0 tp -70.66 -12.84 61.81 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 174.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 70.4 mt-30 -82.64 -10.43 58.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.262 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -139.44 -34.08 0.59 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.7 p . . . . . 0 N--CA 1.426 -1.632 0 CA-C-O 118.654 -0.688 . . . . 0.0 109.578 179.318 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.755 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.81 -32.35 73.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.755 0.788 . . . . 0.0 109.099 177.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -121.0 30.74 6.71 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.815 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -123.55 111.16 15.94 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 172.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.5 m -110.29 138.21 20.82 Favored Pre-proline 0 C--N 1.275 -2.657 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 -175.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.54 130.71 25.74 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 C-N-CA 121.578 1.519 . . . . 0.0 111.303 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 t -73.93 123.86 25.07 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.441 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -58.83 -33.49 70.46 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.631 0.729 . . . . 0.0 110.616 -176.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -83.22 -9.26 59.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -174.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 p -142.04 -20.29 0.72 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.04 1.21 88.8 Favored Glycine 0 C--N 1.31 -0.894 0 C-N-CA 121.134 -0.555 . . . . 0.0 112.44 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.7 m -85.99 138.93 31.62 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 122.458 -0.437 . . . . 0.0 110.246 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.9 mt -75.56 110.5 10.0 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 122.943 0.497 . . . . 0.0 110.017 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 43.1 t -111.13 132.38 21.74 Favored Pre-proline 0 C--N 1.285 -2.212 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.277 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -54.57 130.89 42.53 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.736 2.291 . . . . 0.0 109.933 173.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 p -46.95 -37.89 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.16 0.984 . . . . 0.0 113.463 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.4 p90 -77.26 -12.64 59.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.48 -6.52 33.58 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.5 mmt -51.41 -55.72 26.68 Favored Pre-proline 0 C--O 1.211 -0.928 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -53.18 -49.46 17.43 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 121.694 1.596 . . . . 0.0 111.087 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -53.57 -58.31 7.64 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.973 1.309 . . . . 0.0 111.539 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -65.81 -42.77 90.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.304 -175.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 93.9 mmm -70.12 -27.37 64.53 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.158 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.8 -36.68 75.86 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.89 -45.03 94.43 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.115 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -62.84 -41.08 99.2 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.695 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -57.79 -57.11 14.2 Favored 'General case' 0 N--CA 1.444 -0.731 0 O-C-N 123.578 0.549 . . . . 0.0 109.683 -174.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.18 93.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.173 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.19 -40.64 94.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 110.812 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HA ' ' OXT' ' A' ' 39' ' ' SER . 50.8 mt-10 -87.13 -8.44 56.98 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.44 0.638 . . . . 0.0 110.884 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.2 tp -86.13 -8.7 57.66 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.34 175.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.84 -37.4 84.41 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.524 0.678 . . . . 0.0 110.848 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -156.93 -50.11 0.07 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.437 ' OXT' ' HA ' ' A' ' 35' ' ' GLU . 54.3 m . . . . . 0 C--O 1.255 1.373 0 C-N-CA 128.647 2.779 . . . . 0.0 104.369 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.87 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 62.66 67.08 0.72 Allowed 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -170.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -93.51 12.63 24.47 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.123 -173.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -121.43 103.79 9.2 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 106.336 -1.728 . . . . 0.0 106.336 172.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.5 m -116.99 134.78 22.95 Favored Pre-proline 0 C--N 1.276 -2.629 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.862 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.98 129.38 20.59 Favored 'Trans proline' 0 N--CA 1.441 -1.604 0 C-N-CA 121.562 1.508 . . . . 0.0 110.642 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.3 t -72.83 114.91 11.49 Favored 'General case' 0 C--N 1.282 -2.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -52.04 -33.93 40.97 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.788 0.835 . . . . 0.0 111.461 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -80.99 -9.71 59.81 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -175.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.0 p -143.31 -21.17 0.62 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.34 -4.58 80.48 Favored Glycine 0 C--N 1.314 -0.688 0 C-N-CA 121.621 -0.323 . . . . 0.0 112.759 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -80.54 141.68 34.87 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.413 -0.463 . . . . 0.0 109.825 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 114.34 16.15 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.465 0.65 . . . . 0.0 109.703 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.9 t -115.0 133.06 22.71 Favored Pre-proline 0 C--N 1.29 -1.983 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.084 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.12 136.77 76.98 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.258 1.972 . . . . 0.0 110.157 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.6 p -49.52 -34.53 8.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 C-N-CA 124.003 0.921 . . . . 0.0 112.098 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -79.92 -10.28 59.76 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.45 -13.18 20.69 Favored 'General case' 0 CA--C 1.494 -1.189 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 7.3 mmt -50.93 -54.02 41.57 Favored Pre-proline 0 C--O 1.212 -0.877 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.7 -49.37 16.98 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 121.561 1.507 . . . . 0.0 111.428 176.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -54.14 -55.31 28.98 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 124.698 1.199 . . . . 0.0 111.453 177.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -68.75 -41.3 79.11 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.804 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 13.6 mmt -67.01 -34.82 78.58 Favored 'General case' 0 CA--C 1.485 -1.556 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.094 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.35 -34.44 77.72 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -62.05 -48.64 79.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.668 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.412 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 81.8 m-70 -64.29 -42.03 96.58 Favored 'General case' 0 C--O 1.193 -1.901 0 C-N-CA 119.901 -0.719 . . . . 0.0 110.464 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -57.44 -49.02 77.57 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 122.666 0.386 . . . . 0.0 111.358 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -65.24 -36.17 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.904 0.383 . . . . 0.0 110.326 177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 tp -65.87 -40.91 92.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.723 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 31' ' ' HIS . 50.2 mt-10 -77.9 -25.68 48.64 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 123.25 0.62 . . . . 0.0 109.699 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.587 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 52.5 tp -79.09 0.86 26.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.693 0.759 . . . . 0.0 110.018 -177.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 25.9 mt-30 -87.78 -18.53 29.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.84 175.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -135.64 34.06 2.96 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.255 0.55 . . . . 0.0 110.558 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.587 ' OG ' ' HA ' ' A' ' 36' ' ' LEU . 55.5 m . . . . . 0 C--N 1.305 -1.365 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.27 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 66.69 46.51 1.74 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.462 1.105 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -93.27 39.16 1.05 Allowed 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.958 0.885 . . . . 0.0 109.58 -177.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -125.15 105.73 9.37 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m -107.07 146.54 33.38 Favored Pre-proline 0 C--N 1.275 -2.645 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.47 -173.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.09 130.28 18.67 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.704 1.603 . . . . 0.0 112.082 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.7 t -74.16 117.31 15.81 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.756 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -52.22 -33.84 42.98 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.079 0.552 . . . . 0.0 112.446 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -82.12 -8.91 59.67 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 p -141.92 -25.15 0.68 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.24 -6.3 75.46 Favored Glycine 0 C--O 1.22 -0.729 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.092 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.3 m -79.99 139.06 37.16 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.7 mt -76.8 114.79 15.96 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.414 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 53.1 t -121.41 135.19 24.84 Favored Pre-proline 0 C--N 1.3 -1.565 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.148 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.17 130.14 36.77 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.889 2.392 . . . . 0.0 111.451 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.8 p -50.17 -34.93 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 124.19 0.996 . . . . 0.0 113.092 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -77.14 -17.89 58.28 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -100.74 -3.61 29.76 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.414 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -49.96 -57.92 11.05 Favored Pre-proline 0 N--CA 1.474 0.733 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -56.24 -43.18 58.56 Favored 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 121.89 1.727 . . . . 0.0 111.535 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -56.76 -55.68 31.11 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.882 1.273 . . . . 0.0 110.879 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.15 -44.66 91.46 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.131 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.516 ' O ' ' HD1' ' A' ' 32' ' ' PHE . 8.1 mmt -61.76 -37.09 83.0 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.586 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.93 -33.16 75.19 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 123.583 0.552 . . . . 0.0 109.692 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -62.23 -45.24 94.23 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.822 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -62.15 -41.98 98.82 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.266 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.516 ' HD1' ' O ' ' A' ' 28' ' ' MET . 17.1 m-85 -59.45 -58.04 10.35 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.98 69.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.896 0.379 . . . . 0.0 111.261 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 tp -69.58 -45.64 68.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.368 0.604 . . . . 0.0 110.229 177.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.522 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 43.7 mt-10 -86.95 -3.94 59.13 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.887 0.851 . . . . 0.0 111.571 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.9 tp -75.43 -16.85 60.3 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -87.97 -23.66 23.79 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.271 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 63.6 pttt -80.3 -17.0 53.36 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.456 0.646 . . . . 0.0 111.139 -174.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.299 -1.61 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.715 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.775 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 67.02 26.38 9.04 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 124.094 0.871 . . . . 0.0 111.165 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -93.81 15.18 17.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 122.615 1.198 . . . . 0.0 108.638 175.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -127.11 103.27 7.35 Favored 'General case' 0 N--CA 1.423 -1.823 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 169.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.3 141.47 22.6 Favored Pre-proline 0 C--N 1.281 -2.412 0 CA-C-O 120.677 0.275 . . . . 0.0 111.334 -173.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.22 124.79 12.12 Favored 'Trans proline' 0 N--CA 1.431 -2.178 0 C-N-CA 121.794 1.663 . . . . 0.0 111.954 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.8 t -71.71 117.35 13.18 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.267 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -57.47 -31.33 65.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 123.715 0.634 . . . . 0.0 110.76 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -81.94 -9.54 59.55 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.4 p -143.64 -21.18 0.59 Allowed 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 177.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.77 -2.36 76.5 Favored Glycine 0 C--N 1.313 -0.745 0 C-N-CA 121.496 -0.383 . . . . 0.0 113.384 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.82 140.43 34.19 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.3 mt -81.09 102.47 10.26 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.412 ' HB ' ' HE2' ' A' ' 24' ' ' MET . 31.9 t -100.73 132.35 22.35 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.468 -173.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.92 127.0 23.82 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.548 2.165 . . . . 0.0 110.734 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 p -50.64 -32.34 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 125.221 1.408 . . . . 0.0 113.031 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -74.12 -24.02 59.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 178.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -101.67 -0.48 34.54 Favored 'General case' 0 CA--C 1.492 -1.253 0 O-C-N 121.824 -0.547 . . . . 0.0 110.5 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.439 ' O ' ' HG3' ' A' ' 28' ' ' MET . 0.2 OUTLIER -51.77 -52.68 58.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 179.006 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -59.17 -44.84 31.2 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 121.53 1.486 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.45 -48.42 79.22 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 124.655 1.182 . . . . 0.0 111.316 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -65.46 -42.15 92.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.942 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.439 ' HG3' ' O ' ' A' ' 24' ' ' MET . 49.2 mtp -69.04 -29.82 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.768 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.13 -35.17 73.89 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -64.9 -45.88 84.04 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.833 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -65.16 -34.64 78.87 Favored 'General case' 0 C--O 1.2 -1.524 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.724 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -59.31 -56.14 25.88 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.466 ' O ' ' HB3' ' A' ' 36' ' ' LEU . . . -64.58 -38.96 92.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.871 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 tp -63.92 -42.87 97.26 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-O 121.472 0.653 . . . . 0.0 110.922 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -83.68 -10.19 58.34 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.576 0.703 . . . . 0.0 110.401 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.466 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.5 tt -73.95 -31.26 62.94 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 172.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 90.0 mt-30 -80.12 -48.9 12.47 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 176.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt 51.2 33.73 10.06 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.652 1.581 . . . . 0.0 113.176 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.261 1.666 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.703 177.903 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.156 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 66.61 19.42 10.82 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.396 1.078 . . . . 0.0 111.681 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -122.0 20.28 10.76 Favored 'General case' 0 CA--C 1.488 -1.412 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.003 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -96.6 109.06 21.74 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.481 177.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.8 m -102.53 144.13 27.98 Favored Pre-proline 0 C--N 1.284 -2.245 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.09 125.06 11.56 Favored 'Trans proline' 0 N--CA 1.439 -1.706 0 C-N-CA 121.628 1.552 . . . . 0.0 111.983 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.9 t -72.55 117.55 14.36 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.918 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -55.24 -27.6 47.4 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 124.417 1.087 . . . . 0.0 113.22 -175.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.432 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 61.7 mttm -86.1 -9.56 56.47 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -140.83 -27.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -177.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.22 -7.29 75.83 Favored Glycine 0 C--N 1.308 -1.012 0 C-N-CA 121.273 -0.489 . . . . 0.0 111.945 -178.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 m -77.41 138.0 39.03 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.19 111.73 13.12 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.8 t -113.07 130.54 23.47 Favored Pre-proline 0 C--N 1.283 -2.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.869 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.64 128.88 31.25 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.487 2.125 . . . . 0.0 110.526 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.7 p -48.55 -34.35 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.403 0 C-N-CA 125.479 1.512 . . . . 0.0 112.676 -175.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -77.61 -15.38 59.25 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -100.12 -4.15 30.32 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 7.4 mmt -51.05 -58.27 10.97 Favored Pre-proline 0 C--O 1.208 -1.131 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.2 -46.17 35.83 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.124 1.883 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.93 -51.7 68.94 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 125.116 1.367 . . . . 0.0 112.152 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -64.55 -33.93 77.05 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.548 0.689 . . . . 0.0 109.804 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -36.46 84.32 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.413 175.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.8 -34.7 78.4 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.584 0.552 . . . . 0.0 109.882 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.52 -50.58 70.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.607 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -65.18 -36.69 84.99 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.307 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -56.48 -56.87 15.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -62.2 -46.46 88.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.735 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.8 tp -61.72 -42.76 99.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.591 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.432 ' OE2' ' HD3' ' A' ' 14' ' ' LYS . 47.0 mt-10 -82.4 -18.76 40.79 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.087 0.47 . . . . 0.0 110.803 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.0 tp -76.53 -22.65 54.1 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 28.0 mm-40 -63.28 -43.62 97.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.372 0.606 . . . . 0.0 109.739 178.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -90.77 23.25 3.18 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.403 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 C--O 1.256 1.414 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.653 179.099 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.878 0 CA-C-O 120.891 0.377 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -94.16 12.75 25.48 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 121.31 0.576 . . . . 0.0 110.896 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -93.4 56.69 2.49 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -132.71 115.84 15.86 Favored 'General case' 0 N--CA 1.422 -1.841 0 CA-C-N 113.231 -1.804 . . . . 0.0 106.329 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -103.19 143.04 25.81 Favored Pre-proline 0 C--N 1.283 -2.311 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.07 124.82 12.69 Favored 'Trans proline' 0 N--CA 1.436 -1.87 0 C-N-CA 121.084 1.189 . . . . 0.0 110.158 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.4 t -74.19 110.67 8.67 Favored 'General case' 0 C--N 1.275 -2.652 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.169 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -46.88 -34.03 5.06 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -80.9 -8.99 59.87 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.7 p -142.67 -23.22 0.65 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.88 -7.74 76.67 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.074 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.3 m -78.89 138.69 38.24 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.52 103.85 7.7 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.8 t -106.1 129.02 25.23 Favored Pre-proline 0 C--N 1.283 -2.312 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.353 -175.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.45 130.88 26.54 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.97 2.447 . . . . 0.0 111.291 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.0 p -51.96 -37.64 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.624 -175.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.8 p90 -75.85 -13.24 60.27 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -101.11 -1.12 34.87 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.256 8.6 mmt -52.53 -52.57 62.43 Favored Pre-proline 0 C--O 1.216 -0.701 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -50.85 -53.12 7.69 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.875 1.717 . . . . 0.0 111.161 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.28 -55.85 24.22 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 124.915 1.286 . . . . 0.0 112.077 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -67.54 -41.87 83.59 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.745 -176.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.3 mmm -69.59 -29.27 66.76 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.665 -0.647 . . . . 0.0 111.276 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.89 -29.87 67.17 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -64.9 -47.12 78.95 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.416 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.403 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 83.4 m-70 -65.37 -38.87 91.36 Favored 'General case' 0 C--O 1.195 -1.764 0 C-N-CA 119.59 -0.844 . . . . 0.0 110.718 177.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -58.72 -53.29 59.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.722 0.237 . . . . 0.0 111.601 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -61.62 -40.95 96.66 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.968 178.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.441 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 35.1 tp -63.12 -42.14 99.47 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.456 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 31' ' ' HIS . 46.4 mt-10 -72.42 -28.85 63.23 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.52 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.8 tp -77.28 -25.76 51.7 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.478 0.656 . . . . 0.0 109.532 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.1 mm100 -82.44 -32.41 29.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.684 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -100.06 -22.89 15.04 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -177.019 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--N 1.311 -1.102 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.738 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 121.848 0.832 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -104.2 18.94 21.08 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.293 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -94.53 10.82 33.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.934 0.873 . . . . 0.0 109.695 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -131.52 118.58 20.35 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 170.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.6 m -119.34 143.8 35.13 Favored Pre-proline 0 C--N 1.28 -2.423 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.97 130.62 16.93 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 120.973 1.116 . . . . 0.0 110.21 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.3 t -72.55 110.99 7.32 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.75 -22.73 15.02 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -81.51 -26.41 35.15 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -128.63 -19.14 3.79 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.94 -3.18 85.94 Favored Glycine 0 C--N 1.306 -1.101 0 C-N-CA 121.347 -0.454 . . . . 0.0 112.951 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -79.71 144.68 33.46 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.61 115.01 21.39 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.355 0.598 . . . . 0.0 109.948 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.653 ' HB ' ' SD ' ' A' ' 24' ' ' MET . 28.4 t -113.49 136.19 21.92 Favored Pre-proline 0 C--N 1.291 -1.95 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.482 -177.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -59.26 141.07 97.36 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.021 1.814 . . . . 0.0 110.61 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.5 p -53.83 -34.44 25.26 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 C-N-CA 123.781 0.833 . . . . 0.0 111.361 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -77.6 -19.3 55.79 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -97.61 -7.45 31.09 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.977 -0.452 . . . . 0.0 110.724 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.653 ' SD ' ' HB ' ' A' ' 19' ' ' VAL . 87.7 mmm -51.15 -55.77 25.55 Favored Pre-proline 0 C--N 1.316 -0.854 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -55.49 -45.91 36.16 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.944 1.763 . . . . 0.0 111.129 178.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.63 -53.83 49.62 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 125.327 1.451 . . . . 0.0 110.055 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -66.79 -40.92 88.32 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.542 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 97.3 mmm -69.06 -28.05 66.19 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.836 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -72.59 -30.03 64.02 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.724 0.774 . . . . 0.0 108.925 178.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.9 -47.08 79.06 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.235 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.462 ' HB3' ' OE2' ' A' ' 35' ' ' GLU . 87.6 m-70 -66.91 -33.33 75.35 Favored 'General case' 0 C--O 1.191 -1.976 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.044 177.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -59.62 -51.54 69.38 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -176.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.83 82.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.095 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.46 -36.93 74.45 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.449 0.699 . . . . 0.0 111.64 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' OE2' ' HB3' ' A' ' 31' ' ' HIS . 43.1 mt-10 -83.85 -21.15 32.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 123.439 0.696 . . . . 0.0 111.8 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -76.45 -33.13 58.75 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -80.78 -7.24 59.34 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.414 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 pttp 62.54 -21.11 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 129.148 2.979 . . . . 0.0 115.414 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 CA--C 1.545 0.781 0 C-N-CA 124.08 0.952 . . . . 0.0 109.329 -174.91 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -86.4 -50.93 6.54 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -175.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -116.15 17.3 15.8 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.211 0.529 . . . . 0.0 110.923 -176.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -121.76 117.91 27.76 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 176.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -120.91 129.29 25.37 Favored Pre-proline 0 C--N 1.292 -1.897 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.135 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.76 124.22 11.66 Favored 'Trans proline' 0 N--CA 1.438 -1.754 0 C-N-CA 121.367 1.378 . . . . 0.0 111.335 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.405 ' HB2' ' CG2' ' A' ' 19' ' ' VAL . 43.7 t -74.76 112.83 11.36 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.93 178.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.45 -30.17 60.02 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 124.097 0.959 . . . . 0.0 111.664 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -78.71 -9.67 59.49 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.4 p -143.53 -22.89 0.6 Allowed 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.84 7.61 83.78 Favored Glycine 0 C--N 1.305 -1.144 0 C-N-CA 121.601 -0.333 . . . . 0.0 113.117 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -89.21 144.6 25.99 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.07 106.3 13.86 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.405 ' CG2' ' HB2' ' A' ' 12' ' ' CYS . 46.8 t -92.12 133.67 29.85 Favored Pre-proline 0 C--N 1.279 -2.483 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.742 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.95 126.87 18.16 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 122.144 1.896 . . . . 0.0 109.327 174.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.1 p -47.01 -40.0 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.591 0 C-N-CA 124.488 1.115 . . . . 0.0 113.457 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.4 p90 -66.77 -28.59 68.52 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -106.22 4.78 29.24 Favored 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 121.557 -0.714 . . . . 0.0 111.166 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -53.11 58.91 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.5 -41.58 39.42 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 121.651 1.567 . . . . 0.0 111.127 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -58.19 -48.94 78.77 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.67 1.188 . . . . 0.0 110.618 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -65.28 -42.4 93.2 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.588 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.21 -35.53 80.61 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.001 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -66.48 -34.73 78.59 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 123.764 0.665 . . . . 0.0 110.471 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -63.07 -42.77 99.75 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -63.55 -39.75 95.22 Favored 'General case' 0 C--O 1.194 -1.859 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.534 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.24 -50.91 72.18 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 120.411 0.148 . . . . 0.0 111.31 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -64.57 -42.14 95.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.255 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -62.53 -42.4 99.5 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.013 0.925 . . . . 0.0 111.074 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 52.2 mt-10 -75.4 -20.87 58.67 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.338 178.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.6 tp -83.95 -12.37 55.45 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 28.8 mm-40 -74.75 -2.19 25.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 24.3 pttm -84.77 -9.47 58.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.417 0.627 . . . . 0.0 110.216 176.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.428 -1.525 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.781 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.94 52.27 2.42 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.751 0.786 . . . . 0.0 109.428 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -137.96 72.42 1.41 Allowed 'General case' 0 C--O 1.248 0.977 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.767 -175.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.479 ' HG2' ' HA ' ' A' ' 20' ' ' PRO . 68.1 mt-30 -128.38 156.68 42.74 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.9 m -135.06 138.95 30.56 Favored Pre-proline 0 C--N 1.296 -1.744 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.27 124.95 11.36 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 121.091 1.194 . . . . 0.0 110.885 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.2 t -74.86 111.9 10.54 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.222 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -50.01 -33.27 17.51 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.435 1.094 . . . . 0.0 112.572 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -79.35 -9.4 59.58 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.9 p -142.95 -20.99 0.64 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.46 0.33 86.55 Favored Glycine 0 C--O 1.217 -0.934 0 C-N-CA 121.707 -0.282 . . . . 0.0 112.399 -177.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -82.74 139.43 33.62 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.53 106.79 10.72 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 54.3 t -100.81 132.47 22.12 Favored Pre-proline 0 C--N 1.293 -1.873 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.818 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.479 ' HA ' ' HG2' ' A' ' 9' ' ' GLN . 45.4 Cg_exo -56.7 133.75 60.0 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.003 2.468 . . . . 0.0 110.772 175.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.0 p -52.97 -35.42 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.139 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.0 p90 -74.57 -23.53 58.77 Favored 'General case' 0 CA--C 1.55 0.981 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -105.51 3.23 29.2 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.263 -0.898 . . . . 0.0 110.75 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.96 -54.64 35.17 Favored Pre-proline 0 CA--C 1.563 1.448 0 C-N-CA 123.713 0.805 . . . . 0.0 111.895 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.07 -43.02 32.14 Favored 'Trans proline' 0 C--N 1.385 2.484 0 C-N-CA 121.904 1.736 . . . . 0.0 111.698 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -54.96 -51.87 64.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.484 1.113 . . . . 0.0 110.693 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.9 t60 -66.23 -40.42 90.24 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.863 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.2 mmm -68.26 -29.08 67.79 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.859 177.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -72.18 -31.47 65.95 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -63.77 -48.72 75.82 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.416 176.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -64.41 -37.16 86.56 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.182 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -63.07 -55.21 27.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.49 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -61.55 -34.16 75.09 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 123.162 0.585 . . . . 0.0 111.01 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 tp -68.03 -42.9 79.93 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.518 0.511 . . . . 0.0 110.368 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -86.11 -16.75 37.02 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.259 0.552 . . . . 0.0 110.777 -176.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.2 tp -82.18 -5.83 58.76 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.812 0.815 . . . . 0.0 109.397 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 98.2 mt-30 -73.7 -16.43 61.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.293 62.0 pttt 53.42 2.54 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 127.835 2.454 . . . . 0.0 116.905 175.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.415 -2.22 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.052 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.493 ' C ' ' H ' ' A' ' 8' ' ' ASP . . . . . . . . 0 CA--C 1.504 -0.79 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.08 33.77 0.13 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.469 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 6' ' ' ALA . 2.4 m-20 -98.42 63.25 1.5 Allowed 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 104.061 -2.57 . . . . 0.0 104.061 -178.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.22 144.9 51.16 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.533 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.416 HG21 ' SD ' ' A' ' 24' ' ' MET . 13.5 m -133.16 136.43 27.41 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -66.91 122.15 9.45 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 121.804 1.669 . . . . 0.0 111.42 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.2 t -74.27 115.06 13.35 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.154 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.56 -35.8 42.59 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.739 0.816 . . . . 0.0 112.381 -177.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -76.36 -9.31 58.55 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -173.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.1 p -143.42 -25.7 0.58 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.5 -1.04 75.32 Favored Glycine 0 C--N 1.312 -0.764 0 C-N-CA 121.592 -0.337 . . . . 0.0 113.125 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -80.45 137.91 36.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.279 0.54 . . . . 0.0 109.746 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.33 103.79 6.52 Favored 'General case' 0 CA--C 1.498 -1.039 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.9 t -98.45 134.94 21.38 Favored Pre-proline 0 C--N 1.281 -2.37 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.932 -176.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.09 128.56 27.51 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.612 2.208 . . . . 0.0 109.767 174.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -50.64 -37.95 16.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 124.888 1.275 . . . . 0.0 112.53 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -69.97 -30.37 67.7 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -91.8 -0.12 57.51 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.826 -0.546 . . . . 0.0 111.185 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.416 ' SD ' HG21 ' A' ' 10' ' ' VAL 0.256 0.0 OUTLIER -51.47 -58.48 10.63 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.334 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.01 -45.22 37.55 Favored 'Trans proline' 0 C--N 1.369 1.637 0 C-N-CA 121.948 1.765 . . . . 0.0 111.157 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -54.03 -53.27 55.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.326 1.05 . . . . 0.0 110.858 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -65.99 -38.9 89.7 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 124.182 0.993 . . . . 0.0 110.872 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.5 mtp -68.03 -29.67 68.71 Favored 'General case' 0 C--O 1.203 -1.359 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.402 176.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.15 -32.16 70.01 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -62.99 -45.87 90.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.106 174.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -65.58 -35.6 81.29 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.874 -0.73 . . . . 0.0 109.957 176.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -60.06 -56.35 22.7 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -176.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.17 90.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.995 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 tp -65.53 -41.05 93.51 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.14 -17.05 51.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.166 0.507 . . . . 0.0 109.921 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.7 tp -87.21 -12.46 46.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.756 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -55.85 -52.03 65.46 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -107.13 -3.48 19.87 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.247 0.939 0 C-N-CA 125.05 1.34 . . . . 0.0 110.641 179.904 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.422 -1.866 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.04 125.65 13.37 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 121.19 1.26 . . . . 0.0 112.147 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -74.4 111.59 9.74 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.728 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.15 -23.23 33.42 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 124.085 0.954 . . . . 0.0 113.168 -175.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -82.39 -18.18 42.89 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.3 p -135.07 -27.88 1.21 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.53 -5.24 64.62 Favored Glycine 0 C--N 1.308 -0.973 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.274 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.1 m -76.79 138.12 39.68 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.0 mt -79.04 106.08 10.82 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -108.52 131.4 21.79 Favored Pre-proline 0 C--N 1.288 -2.066 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.636 -174.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.13 127.99 25.55 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.838 2.359 . . . . 0.0 111.212 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.4 p -48.94 -38.53 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 125.464 1.505 . . . . 0.0 112.673 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 38.2 p90 -73.16 -17.17 61.41 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -98.31 -3.43 37.21 Favored 'General case' 0 CA--C 1.489 -1.4 0 O-C-N 122.302 -0.249 . . . . 0.0 110.587 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.42 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.4 mmt -52.41 -49.8 83.41 Favored Pre-proline 0 C--O 1.211 -0.96 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' MET . 9.4 Cg_endo -57.1 -49.07 15.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 121.546 1.497 . . . . 0.0 111.035 177.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -58.01 -50.33 73.77 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 124.616 1.167 . . . . 0.0 112.518 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -68.42 -41.99 79.58 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.292 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 89.5 mmm -66.36 -33.58 76.05 Favored 'General case' 0 CA--C 1.491 -1.298 0 O-C-N 121.883 -0.511 . . . . 0.0 110.847 177.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -67.69 -31.3 71.17 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.413 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -67.81 -40.26 83.86 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.728 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -66.47 -32.2 73.42 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.957 175.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -59.65 -57.96 10.67 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.99 -48.49 78.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.059 0.457 . . . . 0.0 111.234 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.4 tp . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.184 -177.638 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.402 HG23 ' HE2' ' A' ' 24' ' ' MET . 29.1 m . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.8 130.39 21.77 Favored 'Trans proline' 0 N--CA 1.435 -1.951 0 C-N-CA 121.403 1.402 . . . . 0.0 111.287 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.5 t -73.5 123.17 23.39 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.669 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 35.4 mp0 -56.52 -35.86 68.53 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 123.848 0.859 . . . . 0.0 110.879 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -83.19 -9.31 59.24 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -142.75 -23.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.41 -1.52 76.42 Favored Glycine 0 C--N 1.312 -0.783 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.37 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.5 m -81.03 138.42 36.01 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.45 109.91 10.56 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.2 t -112.47 127.89 26.26 Favored Pre-proline 0 C--N 1.294 -1.839 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.0 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.3 133.6 36.65 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.318 2.678 . . . . 0.0 111.676 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.2 p -48.96 -35.87 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 124.756 1.223 . . . . 0.0 112.985 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -79.52 -12.35 59.87 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -103.59 -4.8 23.39 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 121.742 -0.598 . . . . 0.0 110.564 177.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 10' ' ' VAL . 4.4 mmt -50.1 -55.53 23.99 Favored Pre-proline 0 N--CA 1.467 0.399 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.78 -47.36 27.63 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.857 1.705 . . . . 0.0 111.247 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.15 -51.78 67.95 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 124.381 1.072 . . . . 0.0 112.259 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -67.19 -43.51 81.96 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.771 -178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.5 mmm -68.17 -28.13 67.02 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 121.897 -0.502 . . . . 0.0 111.149 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -67.79 -37.93 82.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -62.02 -47.41 84.88 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -63.68 -39.26 93.89 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.854 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.47 -56.74 17.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.896 0.748 . . . . 0.0 109.683 -175.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.89 -38.73 86.83 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.447 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 C--O 1.238 0.48 0 CA-C-O 121.255 0.55 . . . . 0.0 111.118 -178.314 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.432 -1.366 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.19 122.77 9.32 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 121.748 1.632 . . . . 0.0 112.866 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 14.8 t -65.85 120.62 13.37 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 123.887 0.875 . . . . 0.0 109.699 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.85 -22.73 62.68 Favored 'General case' 0 C--N 1.301 -1.527 0 C-N-CA 123.397 0.679 . . . . 0.0 112.819 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.67 -9.32 38.27 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.8 -10.94 0.9 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.59 -5.19 75.31 Favored Glycine 0 C--N 1.312 -0.788 0 C-N-CA 121.017 -0.611 . . . . 0.0 113.178 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.1 m -79.83 138.81 37.31 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 122.487 0.315 . . . . 0.0 110.294 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.5 mt -78.17 100.88 6.79 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.601 0.715 . . . . 0.0 109.195 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.3 t -104.67 133.34 20.23 Favored Pre-proline 0 C--N 1.282 -2.357 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.54 -174.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.19 128.33 28.68 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.367 2.045 . . . . 0.0 110.223 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.23 -35.21 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 C-N-CA 124.467 1.107 . . . . 0.0 112.627 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -75.27 -10.6 59.61 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -102.25 -9.1 20.72 Favored 'General case' 0 CA--C 1.503 -0.863 0 C-N-CA 122.829 0.451 . . . . 0.0 110.203 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.3 mmt -50.05 -55.14 26.4 Favored Pre-proline 0 N--CA 1.472 0.634 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -54.25 -50.04 14.91 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 121.998 1.799 . . . . 0.0 111.616 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -62.4 -46.42 88.69 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 124.226 1.01 . . . . 0.0 112.753 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -66.13 -46.4 77.65 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 123.084 0.554 . . . . 0.0 111.187 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.7 mmm -66.26 -29.5 69.75 Favored 'General case' 0 C--N 1.311 -1.08 0 O-C-N 121.878 -0.514 . . . . 0.0 110.528 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.39 -32.68 73.75 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.839 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -66.49 -45.58 79.15 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.674 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -66.36 -33.31 75.45 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.426 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -62.65 -58.43 7.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.58 -28.9 68.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.743 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.264 0.554 . . . . 0.0 110.601 179.034 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.434 -1.267 0 CA-C-O 120.627 0.251 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.54 124.63 12.67 Favored 'Trans proline' 0 N--CA 1.44 -1.664 0 C-N-CA 121.76 1.64 . . . . 0.0 111.316 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -70.84 117.41 12.31 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.43 -30.72 67.12 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -79.97 -8.89 59.58 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -142.33 -26.03 0.64 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.44 -9.33 69.29 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.945 -0.645 . . . . 0.0 113.045 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -74.88 138.93 42.78 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.06 103.37 7.95 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 49.3 t -108.0 133.61 20.43 Favored Pre-proline 0 C--N 1.294 -1.814 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.307 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.03 137.85 82.93 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.932 2.421 . . . . 0.0 112.112 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.5 p -50.73 -36.44 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 124.745 1.218 . . . . 0.0 112.399 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.8 p90 -71.23 -22.0 62.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.0 -11.31 36.37 Favored 'General case' 0 CA--C 1.491 -1.312 0 O-C-N 122.423 -0.173 . . . . 0.0 110.67 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.257 9.2 mmt -49.39 -56.34 16.88 Favored Pre-proline 0 C--O 1.219 -0.519 0 N-CA-C 116.254 1.946 . . . . 0.0 116.254 -174.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.67 -53.53 5.96 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.872 1.715 . . . . 0.0 111.511 179.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -55.37 -49.9 71.08 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.236 1.014 . . . . 0.0 112.186 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -66.9 -44.6 80.4 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.334 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 67.3 mtp -65.22 -36.18 83.37 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.766 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -70.96 -30.41 66.69 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.153 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 93.8 t80 -64.49 -40.44 95.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -63.86 -39.63 94.67 Favored 'General case' 0 C--O 1.202 -1.441 0 C-N-CA 120.276 -0.569 . . . . 0.0 110.151 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -56.7 -49.45 75.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 123.124 0.265 . . . . 0.0 111.605 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.24 -40.57 96.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.154 0.502 . . . . 0.0 110.286 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp . . . . . 0 C--N 1.319 -0.725 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 -178.76 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.433 -1.319 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -70.74 131.83 20.61 Favored 'Trans proline' 0 N--CA 1.434 -2.009 0 C-N-CA 121.19 1.26 . . . . 0.0 111.493 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.3 t -74.03 116.42 14.63 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.304 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.34 -25.38 34.54 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -88.68 -9.91 50.38 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.9 p -142.57 -15.63 0.73 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.89 -1.87 86.98 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.704 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.1 m -82.27 134.33 35.28 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 122.522 -0.399 . . . . 0.0 110.318 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -77.9 100.99 6.6 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.4 t -104.9 133.82 19.96 Favored Pre-proline 0 C--N 1.285 -2.206 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.174 -175.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -49.99 128.99 23.52 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 122.893 2.396 . . . . 0.0 111.13 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.9 p -48.52 -34.48 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.193 0 C-N-CA 124.948 1.299 . . . . 0.0 112.594 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 31.4 p90 -74.78 -16.93 60.7 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -98.74 -6.71 28.93 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 121.932 -0.48 . . . . 0.0 110.354 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.265 7.3 mmt -51.27 -57.55 13.69 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.97 -50.53 13.05 Favored 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.072 1.848 . . . . 0.0 111.325 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -54.57 -58.1 8.82 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.635 1.174 . . . . 0.0 113.177 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -63.28 -46.09 88.41 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.51 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.1 mmm -64.79 -36.35 84.05 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.257 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -69.61 -29.08 66.5 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.386 0.613 . . . . 0.0 110.122 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -63.55 -45.47 90.36 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.338 -0.846 . . . . 0.0 108.909 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -63.47 -41.69 98.6 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.191 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -54.51 -58.27 8.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 123.267 0.354 . . . . 0.0 111.633 -178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.45 -35.93 80.19 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.495 0.497 . . . . 0.0 111.604 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.481 0.658 . . . . 0.0 110.907 -178.605 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.5 m . . . . . 0 N--CA 1.422 -1.853 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.54 130.71 25.74 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 C-N-CA 121.578 1.519 . . . . 0.0 111.303 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 t -73.93 123.86 25.07 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.441 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.483 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 23.7 mp0 -58.83 -33.49 70.46 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.631 0.729 . . . . 0.0 110.616 -176.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -83.22 -9.26 59.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -174.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 p -142.04 -20.29 0.72 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.04 1.21 88.8 Favored Glycine 0 C--N 1.31 -0.894 0 C-N-CA 121.134 -0.555 . . . . 0.0 112.44 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.7 m -85.99 138.93 31.62 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 122.458 -0.437 . . . . 0.0 110.246 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.9 mt -75.56 110.5 10.0 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 122.943 0.497 . . . . 0.0 110.017 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 43.1 t -111.13 132.38 21.74 Favored Pre-proline 0 C--N 1.285 -2.212 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.277 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -54.57 130.89 42.53 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.736 2.291 . . . . 0.0 109.933 173.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 p -46.95 -37.89 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.16 0.984 . . . . 0.0 113.463 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.4 p90 -77.26 -12.64 59.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.48 -6.52 33.58 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.5 mmt -51.41 -55.72 26.68 Favored Pre-proline 0 C--O 1.211 -0.928 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -53.18 -49.46 17.43 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 121.694 1.596 . . . . 0.0 111.087 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -53.57 -58.31 7.64 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.973 1.309 . . . . 0.0 111.539 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -65.81 -42.77 90.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.304 -175.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 93.9 mmm -70.12 -27.37 64.53 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.158 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.8 -36.68 75.86 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.89 -45.03 94.43 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.115 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -62.84 -41.08 99.2 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.695 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -57.79 -57.11 14.2 Favored 'General case' 0 N--CA 1.444 -0.731 0 O-C-N 123.578 0.549 . . . . 0.0 109.683 -174.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.18 93.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.173 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 110.812 -179.654 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.507 HG23 ' HE2' ' A' ' 24' ' ' MET . 18.5 m . . . . . 0 N--CA 1.431 -1.387 0 CA-C-O 120.634 0.254 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.98 129.38 20.59 Favored 'Trans proline' 0 N--CA 1.441 -1.604 0 C-N-CA 121.562 1.508 . . . . 0.0 110.642 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.3 t -72.83 114.91 11.49 Favored 'General case' 0 C--N 1.282 -2.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -52.04 -33.93 40.97 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.788 0.835 . . . . 0.0 111.461 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -80.99 -9.71 59.81 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -175.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.0 p -143.31 -21.17 0.62 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.34 -4.58 80.48 Favored Glycine 0 C--N 1.314 -0.688 0 C-N-CA 121.621 -0.323 . . . . 0.0 112.759 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -80.54 141.68 34.87 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.413 -0.463 . . . . 0.0 109.825 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 114.34 16.15 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.465 0.65 . . . . 0.0 109.703 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.9 t -115.0 133.06 22.71 Favored Pre-proline 0 C--N 1.29 -1.983 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.084 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.12 136.77 76.98 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.258 1.972 . . . . 0.0 110.157 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.6 p -49.52 -34.53 8.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 C-N-CA 124.003 0.921 . . . . 0.0 112.098 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -79.92 -10.28 59.76 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.45 -13.18 20.69 Favored 'General case' 0 CA--C 1.494 -1.189 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.507 ' HE2' HG23 ' A' ' 10' ' ' VAL . 7.3 mmt -50.93 -54.02 41.57 Favored Pre-proline 0 C--O 1.212 -0.877 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.7 -49.37 16.98 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 121.561 1.507 . . . . 0.0 111.428 176.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -54.14 -55.31 28.98 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 124.698 1.199 . . . . 0.0 111.453 177.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -68.75 -41.3 79.11 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.804 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 13.6 mmt -67.01 -34.82 78.58 Favored 'General case' 0 CA--C 1.485 -1.556 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.094 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.35 -34.44 77.72 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -62.05 -48.64 79.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.668 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -64.29 -42.03 96.58 Favored 'General case' 0 C--O 1.193 -1.901 0 C-N-CA 119.901 -0.719 . . . . 0.0 110.464 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -57.44 -49.02 77.57 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 122.666 0.386 . . . . 0.0 111.358 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.17 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.904 0.383 . . . . 0.0 110.326 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 tp . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.723 178.923 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.09 130.28 18.67 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.704 1.603 . . . . 0.0 112.082 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.7 t -74.16 117.31 15.81 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.756 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -52.22 -33.84 42.98 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.079 0.552 . . . . 0.0 112.446 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -82.12 -8.91 59.67 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 p -141.92 -25.15 0.68 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.24 -6.3 75.46 Favored Glycine 0 C--O 1.22 -0.729 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.092 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.3 m -79.99 139.06 37.16 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.7 mt -76.8 114.79 15.96 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.425 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 53.1 t -121.41 135.19 24.84 Favored Pre-proline 0 C--N 1.3 -1.565 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.148 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.17 130.14 36.77 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.889 2.392 . . . . 0.0 111.451 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.8 p -50.17 -34.93 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 124.19 0.996 . . . . 0.0 113.092 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -77.14 -17.89 58.28 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -100.74 -3.61 29.76 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.425 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -49.96 -57.92 11.05 Favored Pre-proline 0 N--CA 1.474 0.733 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -56.24 -43.18 58.56 Favored 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 121.89 1.727 . . . . 0.0 111.535 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -56.76 -55.68 31.11 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.882 1.273 . . . . 0.0 110.879 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.15 -44.66 91.46 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.131 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.52 ' O ' ' HD1' ' A' ' 32' ' ' PHE . 8.1 mmt -61.76 -37.09 83.0 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.586 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.93 -33.16 75.19 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 123.583 0.552 . . . . 0.0 109.692 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -62.23 -45.24 94.23 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.822 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -62.15 -41.98 98.82 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.266 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.52 ' HD1' ' O ' ' A' ' 28' ' ' MET . 17.1 m-85 -59.45 -58.04 10.35 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.98 69.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.896 0.379 . . . . 0.0 111.261 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.368 0.604 . . . . 0.0 110.229 177.255 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.435 -1.196 0 CA-C-O 120.677 0.275 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.22 124.79 12.12 Favored 'Trans proline' 0 N--CA 1.431 -2.178 0 C-N-CA 121.794 1.663 . . . . 0.0 111.954 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.8 t -71.71 117.35 13.18 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.267 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -57.47 -31.33 65.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 123.715 0.634 . . . . 0.0 110.76 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -81.94 -9.54 59.55 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.4 p -143.64 -21.18 0.59 Allowed 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 177.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.77 -2.36 76.5 Favored Glycine 0 C--N 1.313 -0.745 0 C-N-CA 121.496 -0.383 . . . . 0.0 113.384 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.82 140.43 34.19 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.3 mt -81.09 102.47 10.26 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 31.9 t -100.73 132.35 22.35 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.468 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.92 127.0 23.82 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.548 2.165 . . . . 0.0 110.734 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 p -50.64 -32.34 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 125.221 1.408 . . . . 0.0 113.031 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -74.12 -24.02 59.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 178.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -101.67 -0.48 34.54 Favored 'General case' 0 CA--C 1.492 -1.253 0 O-C-N 121.824 -0.547 . . . . 0.0 110.5 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 28' ' ' MET . 0.2 OUTLIER -51.77 -52.68 58.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 179.006 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -59.17 -44.84 31.2 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 121.53 1.486 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.45 -48.42 79.22 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 124.655 1.182 . . . . 0.0 111.316 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -65.46 -42.15 92.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.942 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 24' ' ' MET . 49.2 mtp -69.04 -29.82 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.768 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.13 -35.17 73.89 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -64.9 -45.88 84.04 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.833 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -65.16 -34.64 78.87 Favored 'General case' 0 C--O 1.2 -1.524 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.724 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -59.31 -56.14 25.88 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.58 -38.96 92.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.871 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 tp . . . . . 0 CA--C 1.549 0.912 0 CA-C-O 121.472 0.653 . . . . 0.0 110.922 179.843 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.428 -1.558 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.09 125.06 11.56 Favored 'Trans proline' 0 N--CA 1.439 -1.706 0 C-N-CA 121.628 1.552 . . . . 0.0 111.983 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.9 t -72.55 117.55 14.36 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.918 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -55.24 -27.6 47.4 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 124.417 1.087 . . . . 0.0 113.22 -175.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -86.1 -9.56 56.47 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -140.83 -27.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -177.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.22 -7.29 75.83 Favored Glycine 0 C--N 1.308 -1.012 0 C-N-CA 121.273 -0.489 . . . . 0.0 111.945 -178.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 m -77.41 138.0 39.03 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.19 111.73 13.12 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.404 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 24.8 t -113.07 130.54 23.47 Favored Pre-proline 0 C--N 1.283 -2.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.869 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.64 128.88 31.25 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.487 2.125 . . . . 0.0 110.526 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.7 p -48.55 -34.35 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.403 0 C-N-CA 125.479 1.512 . . . . 0.0 112.676 -175.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -77.61 -15.38 59.25 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -100.12 -4.15 30.32 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.404 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -51.05 -58.27 10.97 Favored Pre-proline 0 C--O 1.208 -1.131 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.2 -46.17 35.83 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.124 1.883 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.93 -51.7 68.94 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 125.116 1.367 . . . . 0.0 112.152 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -64.55 -33.93 77.05 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.548 0.689 . . . . 0.0 109.804 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.427 ' HA ' ' CE ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -64.61 -36.46 84.32 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.413 175.135 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.8 -34.7 78.4 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.584 0.552 . . . . 0.0 109.882 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.52 -50.58 70.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.607 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -65.18 -36.69 84.99 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.307 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -56.48 -56.87 15.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.46 88.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.735 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.591 -176.832 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.427 -1.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.07 124.82 12.69 Favored 'Trans proline' 0 N--CA 1.436 -1.87 0 C-N-CA 121.084 1.189 . . . . 0.0 110.158 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.4 t -74.19 110.67 8.67 Favored 'General case' 0 C--N 1.275 -2.652 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.169 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -46.88 -34.03 5.06 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -80.9 -8.99 59.87 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.7 p -142.67 -23.22 0.65 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.88 -7.74 76.67 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.074 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.3 m -78.89 138.69 38.24 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.52 103.85 7.7 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.8 t -106.1 129.02 25.23 Favored Pre-proline 0 C--N 1.283 -2.312 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.353 -175.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.45 130.88 26.54 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.97 2.447 . . . . 0.0 111.291 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.0 p -51.96 -37.64 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.624 -175.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.8 p90 -75.85 -13.24 60.27 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -101.11 -1.12 34.87 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.256 8.6 mmt -52.53 -52.57 62.43 Favored Pre-proline 0 C--O 1.216 -0.701 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -50.85 -53.12 7.69 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.875 1.717 . . . . 0.0 111.161 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.28 -55.85 24.22 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 124.915 1.286 . . . . 0.0 112.077 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -67.54 -41.87 83.59 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.745 -176.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.3 mmm -69.59 -29.27 66.76 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.665 -0.647 . . . . 0.0 111.276 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.89 -29.87 67.17 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -64.9 -47.12 78.95 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.416 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.4 m-70 -65.37 -38.87 91.36 Favored 'General case' 0 C--O 1.195 -1.764 0 C-N-CA 119.59 -0.844 . . . . 0.0 110.718 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -58.72 -53.29 59.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.722 0.237 . . . . 0.0 111.601 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.62 -40.95 96.66 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.968 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.1 tp . . . . . 0 CA--C 1.537 0.479 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.456 -179.075 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.6 m . . . . . 0 N--CA 1.428 -1.562 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.97 130.62 16.93 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 120.973 1.116 . . . . 0.0 110.21 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.3 t -72.55 110.99 7.32 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.75 -22.73 15.02 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -81.51 -26.41 35.15 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -128.63 -19.14 3.79 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.94 -3.18 85.94 Favored Glycine 0 C--N 1.306 -1.101 0 C-N-CA 121.347 -0.454 . . . . 0.0 112.951 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -79.71 144.68 33.46 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.61 115.01 21.39 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.355 0.598 . . . . 0.0 109.948 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.655 ' HB ' ' SD ' ' A' ' 24' ' ' MET . 28.4 t -113.49 136.19 21.92 Favored Pre-proline 0 C--N 1.291 -1.95 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.482 -177.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -59.26 141.07 97.36 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.021 1.814 . . . . 0.0 110.61 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.5 p -53.83 -34.44 25.26 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 C-N-CA 123.781 0.833 . . . . 0.0 111.361 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -77.6 -19.3 55.79 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -97.61 -7.45 31.09 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.977 -0.452 . . . . 0.0 110.724 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.655 ' SD ' ' HB ' ' A' ' 19' ' ' VAL . 87.7 mmm -51.15 -55.77 25.55 Favored Pre-proline 0 C--N 1.316 -0.854 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -55.49 -45.91 36.16 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.944 1.763 . . . . 0.0 111.129 178.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.63 -53.83 49.62 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 125.327 1.451 . . . . 0.0 110.055 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -66.79 -40.92 88.32 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.542 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 97.3 mmm -69.06 -28.05 66.19 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.836 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -72.59 -30.03 64.02 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.724 0.774 . . . . 0.0 108.925 178.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.9 -47.08 79.06 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.235 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -66.91 -33.33 75.35 Favored 'General case' 0 C--O 1.191 -1.976 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.044 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -59.62 -51.54 69.38 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -176.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.83 82.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.095 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 tp . . . . . 0 CA--C 1.552 1.027 0 C-N-CA 123.449 0.699 . . . . 0.0 111.64 -179.274 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.76 124.22 11.66 Favored 'Trans proline' 0 N--CA 1.438 -1.754 0 C-N-CA 121.367 1.378 . . . . 0.0 111.335 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 19' ' ' VAL . 43.7 t -74.76 112.83 11.36 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.93 178.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.45 -30.17 60.02 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 124.097 0.959 . . . . 0.0 111.664 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -78.71 -9.67 59.49 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.4 p -143.53 -22.89 0.6 Allowed 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.84 7.61 83.78 Favored Glycine 0 C--N 1.305 -1.144 0 C-N-CA 121.601 -0.333 . . . . 0.0 113.117 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -89.21 144.6 25.99 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.07 106.3 13.86 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.443 ' CG2' ' HB2' ' A' ' 12' ' ' CYS . 46.8 t -92.12 133.67 29.85 Favored Pre-proline 0 C--N 1.279 -2.483 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.742 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.95 126.87 18.16 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 122.144 1.896 . . . . 0.0 109.327 174.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.1 p -47.01 -40.0 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.591 0 C-N-CA 124.488 1.115 . . . . 0.0 113.457 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.4 p90 -66.77 -28.59 68.52 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -106.22 4.78 29.24 Favored 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 121.557 -0.714 . . . . 0.0 111.166 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -53.11 58.91 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.5 -41.58 39.42 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 121.651 1.567 . . . . 0.0 111.127 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -58.19 -48.94 78.77 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.67 1.188 . . . . 0.0 110.618 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -65.28 -42.4 93.2 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.588 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.21 -35.53 80.61 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.001 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -66.48 -34.73 78.59 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 123.764 0.665 . . . . 0.0 110.471 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -63.07 -42.77 99.75 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -63.55 -39.75 95.22 Favored 'General case' 0 C--O 1.194 -1.859 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.534 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.24 -50.91 72.18 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 120.411 0.148 . . . . 0.0 111.31 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.14 95.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.255 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp . . . . . 0 N--CA 1.465 0.297 0 C-N-CA 124.013 0.925 . . . . 0.0 111.074 -179.568 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.439 -0.993 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.27 124.95 11.36 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 121.091 1.194 . . . . 0.0 110.885 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.2 t -74.86 111.9 10.54 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.222 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -50.01 -33.27 17.51 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.435 1.094 . . . . 0.0 112.572 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -79.35 -9.4 59.58 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.9 p -142.95 -20.99 0.64 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.46 0.33 86.55 Favored Glycine 0 C--O 1.217 -0.934 0 C-N-CA 121.707 -0.282 . . . . 0.0 112.399 -177.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -82.74 139.43 33.62 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.53 106.79 10.72 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 54.3 t -100.81 132.47 22.12 Favored Pre-proline 0 C--N 1.293 -1.873 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.818 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.7 133.75 60.0 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.003 2.468 . . . . 0.0 110.772 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.0 p -52.97 -35.42 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.139 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.0 p90 -74.57 -23.53 58.77 Favored 'General case' 0 CA--C 1.55 0.981 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -105.51 3.23 29.2 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.263 -0.898 . . . . 0.0 110.75 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.96 -54.64 35.17 Favored Pre-proline 0 CA--C 1.563 1.448 0 C-N-CA 123.713 0.805 . . . . 0.0 111.895 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.07 -43.02 32.14 Favored 'Trans proline' 0 C--N 1.385 2.484 0 C-N-CA 121.904 1.736 . . . . 0.0 111.698 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -54.96 -51.87 64.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.484 1.113 . . . . 0.0 110.693 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.9 t60 -66.23 -40.42 90.24 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.863 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.2 mmm -68.26 -29.08 67.79 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.859 177.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -72.18 -31.47 65.95 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -63.77 -48.72 75.82 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.416 176.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -64.41 -37.16 86.56 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.182 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -63.07 -55.21 27.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.55 -34.16 75.09 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 123.162 0.585 . . . . 0.0 111.01 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 tp . . . . . 0 C--N 1.321 -0.652 0 O-C-N 123.518 0.511 . . . . 0.0 110.368 -179.709 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG23 ' SD ' ' A' ' 24' ' ' MET . 13.5 m . . . . . 0 N--CA 1.437 -1.099 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -66.91 122.15 9.45 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 121.804 1.669 . . . . 0.0 111.42 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.2 t -74.27 115.06 13.35 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.154 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.56 -35.8 42.59 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.739 0.816 . . . . 0.0 112.381 -177.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -76.36 -9.31 58.55 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -173.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.1 p -143.42 -25.7 0.58 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.5 -1.04 75.32 Favored Glycine 0 C--N 1.312 -0.764 0 C-N-CA 121.592 -0.337 . . . . 0.0 113.125 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -80.45 137.91 36.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.279 0.54 . . . . 0.0 109.746 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.33 103.79 6.52 Favored 'General case' 0 CA--C 1.498 -1.039 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.9 t -98.45 134.94 21.38 Favored Pre-proline 0 C--N 1.281 -2.37 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.932 -176.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.09 128.56 27.51 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.612 2.208 . . . . 0.0 109.767 174.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -50.64 -37.95 16.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 124.888 1.275 . . . . 0.0 112.53 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -69.97 -30.37 67.7 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -91.8 -0.12 57.51 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.826 -0.546 . . . . 0.0 111.185 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.425 ' SD ' HG23 ' A' ' 10' ' ' VAL 0.256 0.0 OUTLIER -51.47 -58.48 10.63 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.334 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.01 -45.22 37.55 Favored 'Trans proline' 0 C--N 1.369 1.637 0 C-N-CA 121.948 1.765 . . . . 0.0 111.157 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -54.03 -53.27 55.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.326 1.05 . . . . 0.0 110.858 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -65.99 -38.9 89.7 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 124.182 0.993 . . . . 0.0 110.872 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.5 mtp -68.03 -29.67 68.71 Favored 'General case' 0 C--O 1.203 -1.359 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.402 176.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.15 -32.16 70.01 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -62.99 -45.87 90.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.106 174.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -65.58 -35.6 81.29 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.874 -0.73 . . . . 0.0 109.957 176.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -60.06 -56.35 22.7 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -176.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.17 90.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.995 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 tp . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 -179.395 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.923 0 CA-C-O 120.918 0.39 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.15 52.87 2.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.486 0.66 . . . . 0.0 111.229 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -101.1 18.01 20.9 Favored 'General case' 0 CA--C 1.48 -1.732 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.199 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -93.7 109.69 21.34 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.6 m -102.36 144.9 29.53 Favored Pre-proline 0 C--N 1.282 -2.359 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.04 125.65 13.37 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 121.19 1.26 . . . . 0.0 112.147 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -74.4 111.59 9.74 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.728 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.15 -23.23 33.42 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 124.085 0.954 . . . . 0.0 113.168 -175.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -82.39 -18.18 42.89 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.3 p -135.07 -27.88 1.21 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.53 -5.24 64.62 Favored Glycine 0 C--N 1.308 -0.973 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.274 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.1 m -76.79 138.12 39.68 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.0 mt -79.04 106.08 10.82 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -108.52 131.4 21.79 Favored Pre-proline 0 C--N 1.288 -2.066 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.636 -174.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.13 127.99 25.55 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.838 2.359 . . . . 0.0 111.212 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.4 p -48.94 -38.53 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 125.464 1.505 . . . . 0.0 112.673 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 38.2 p90 -73.16 -17.17 61.41 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -98.31 -3.43 37.21 Favored 'General case' 0 CA--C 1.489 -1.4 0 O-C-N 122.302 -0.249 . . . . 0.0 110.587 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.42 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.4 mmt -52.41 -49.8 83.41 Favored Pre-proline 0 C--O 1.211 -0.96 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' MET . 9.4 Cg_endo -57.1 -49.07 15.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 121.546 1.497 . . . . 0.0 111.035 177.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -58.01 -50.33 73.77 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 124.616 1.167 . . . . 0.0 112.518 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -68.42 -41.99 79.58 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.292 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 89.5 mmm -66.36 -33.58 76.05 Favored 'General case' 0 CA--C 1.491 -1.298 0 O-C-N 121.883 -0.511 . . . . 0.0 110.847 177.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -67.69 -31.3 71.17 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.413 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -67.81 -40.26 83.86 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.728 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -66.47 -32.2 73.42 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.957 175.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -59.65 -57.96 10.67 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.99 -48.49 78.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.059 0.457 . . . . 0.0 111.234 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.4 tp -59.73 -46.57 88.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.184 -177.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 51.5 mt-10 -85.21 -11.34 55.16 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.79 -34.51 52.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 175.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -70.08 -4.01 19.17 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -178.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 65.4 pttt -105.06 -1.4 25.69 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.328 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.243 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.666 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 71.0 23.19 4.3 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.653 1.181 . . . . 0.0 111.13 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -94.11 16.04 15.63 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.44 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 93.8 mt-30 -108.91 107.64 18.1 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 169.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.402 HG23 ' HE2' ' A' ' 24' ' ' MET . 29.1 m -98.86 142.24 24.27 Favored Pre-proline 0 C--N 1.279 -2.496 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.8 130.39 21.77 Favored 'Trans proline' 0 N--CA 1.435 -1.951 0 C-N-CA 121.403 1.402 . . . . 0.0 111.287 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.5 t -73.5 123.17 23.39 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.669 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 35.4 mp0 -56.52 -35.86 68.53 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 123.848 0.859 . . . . 0.0 110.879 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -83.19 -9.31 59.24 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -142.75 -23.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.41 -1.52 76.42 Favored Glycine 0 C--N 1.312 -0.783 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.37 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.5 m -81.03 138.42 36.01 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.45 109.91 10.56 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.2 t -112.47 127.89 26.26 Favored Pre-proline 0 C--N 1.294 -1.839 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.0 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 76.0 Cg_exo -50.3 133.6 36.65 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.318 2.678 . . . . 0.0 111.676 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.2 p -48.96 -35.87 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 124.756 1.223 . . . . 0.0 112.985 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -79.52 -12.35 59.87 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -103.59 -4.8 23.39 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 121.742 -0.598 . . . . 0.0 110.564 177.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 10' ' ' VAL . 4.4 mmt -50.1 -55.53 23.99 Favored Pre-proline 0 N--CA 1.467 0.399 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.78 -47.36 27.63 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.857 1.705 . . . . 0.0 111.247 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.15 -51.78 67.95 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 124.381 1.072 . . . . 0.0 112.259 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -67.19 -43.51 81.96 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.771 -178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.5 mmm -68.17 -28.13 67.02 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 121.897 -0.502 . . . . 0.0 111.149 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -67.79 -37.93 82.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -62.02 -47.41 84.88 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -63.68 -39.26 93.89 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.854 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.47 -56.74 17.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.896 0.748 . . . . 0.0 109.683 -175.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.89 -38.73 86.83 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.447 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -64.69 -44.77 89.24 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.255 0.55 . . . . 0.0 111.118 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -82.34 -22.02 35.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.897 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.36 -30.07 69.77 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.087 0.47 . . . . 0.0 109.931 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -59.87 -38.57 82.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.367 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -99.6 -1.14 38.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.076 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.434 -1.264 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.496 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.316 0 CA-C-O 121.155 0.503 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.51 24.22 6.72 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -94.27 16.92 13.75 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.257 0.551 . . . . 0.0 111.532 -172.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -105.49 108.75 20.44 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 168.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.5 m -102.84 142.9 25.51 Favored Pre-proline 0 C--N 1.281 -2.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.0 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.19 122.77 9.32 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 121.748 1.632 . . . . 0.0 112.866 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 14.8 t -65.85 120.62 13.37 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 123.887 0.875 . . . . 0.0 109.699 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.85 -22.73 62.68 Favored 'General case' 0 C--N 1.301 -1.527 0 C-N-CA 123.397 0.679 . . . . 0.0 112.819 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.67 -9.32 38.27 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.8 -10.94 0.9 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.59 -5.19 75.31 Favored Glycine 0 C--N 1.312 -0.788 0 C-N-CA 121.017 -0.611 . . . . 0.0 113.178 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.1 m -79.83 138.81 37.31 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 122.487 0.315 . . . . 0.0 110.294 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.5 mt -78.17 100.88 6.79 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.601 0.715 . . . . 0.0 109.195 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.3 t -104.67 133.34 20.23 Favored Pre-proline 0 C--N 1.282 -2.357 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.54 -174.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.19 128.33 28.68 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.367 2.045 . . . . 0.0 110.223 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.23 -35.21 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 C-N-CA 124.467 1.107 . . . . 0.0 112.627 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -75.27 -10.6 59.61 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -102.25 -9.1 20.72 Favored 'General case' 0 CA--C 1.503 -0.863 0 C-N-CA 122.829 0.451 . . . . 0.0 110.203 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.3 mmt -50.05 -55.14 26.4 Favored Pre-proline 0 N--CA 1.472 0.634 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -54.25 -50.04 14.91 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 121.998 1.799 . . . . 0.0 111.616 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -62.4 -46.42 88.69 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 124.226 1.01 . . . . 0.0 112.753 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -66.13 -46.4 77.65 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 123.084 0.554 . . . . 0.0 111.187 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.7 mmm -66.26 -29.5 69.75 Favored 'General case' 0 C--N 1.311 -1.08 0 O-C-N 121.878 -0.514 . . . . 0.0 110.528 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.39 -32.68 73.75 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.839 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -66.49 -45.58 79.15 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.674 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -66.36 -33.31 75.45 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.426 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.533 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 17.2 t80 -62.65 -58.43 7.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -176.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.58 -28.9 68.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.743 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.0 tp -68.08 -44.28 76.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.264 0.554 . . . . 0.0 110.601 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.663 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 43.5 mt-10 -98.34 -1.66 41.17 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.403 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 32' ' ' PHE . 21.1 tp -58.46 -22.72 55.6 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 123.343 0.657 . . . . 0.0 111.224 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.75 -19.08 61.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.13 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.663 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 18.1 ptpt -101.68 9.0 41.42 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.259 1.604 0 CA-C-O 118.646 -0.693 . . . . 0.0 109.998 -177.855 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 68.94 -37.98 0.38 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 171.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -94.02 16.1 15.34 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.225 0.536 . . . . 0.0 111.137 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -135.95 108.04 7.2 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -116.56 147.72 40.33 Favored Pre-proline 0 C--N 1.28 -2.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.792 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.54 124.63 12.67 Favored 'Trans proline' 0 N--CA 1.44 -1.664 0 C-N-CA 121.76 1.64 . . . . 0.0 111.316 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -70.84 117.41 12.31 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.43 -30.72 67.12 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -79.97 -8.89 59.58 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -142.33 -26.03 0.64 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.44 -9.33 69.29 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.945 -0.645 . . . . 0.0 113.045 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -74.88 138.93 42.78 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.06 103.37 7.95 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 49.3 t -108.0 133.61 20.43 Favored Pre-proline 0 C--N 1.294 -1.814 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.307 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.03 137.85 82.93 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.932 2.421 . . . . 0.0 112.112 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.5 p -50.73 -36.44 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 124.745 1.218 . . . . 0.0 112.399 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.8 p90 -71.23 -22.0 62.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.0 -11.31 36.37 Favored 'General case' 0 CA--C 1.491 -1.312 0 O-C-N 122.423 -0.173 . . . . 0.0 110.67 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.257 9.2 mmt -49.39 -56.34 16.88 Favored Pre-proline 0 C--O 1.219 -0.519 0 N-CA-C 116.254 1.946 . . . . 0.0 116.254 -174.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.67 -53.53 5.96 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.872 1.715 . . . . 0.0 111.511 179.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -55.37 -49.9 71.08 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.236 1.014 . . . . 0.0 112.186 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -66.9 -44.6 80.4 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.334 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 67.3 mtp -65.22 -36.18 83.37 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.766 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -70.96 -30.41 66.69 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.153 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 93.8 t80 -64.49 -40.44 95.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -63.86 -39.63 94.67 Favored 'General case' 0 C--O 1.202 -1.441 0 C-N-CA 120.276 -0.569 . . . . 0.0 110.151 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -56.7 -49.45 75.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 123.124 0.265 . . . . 0.0 111.605 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.24 -40.57 96.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.154 0.502 . . . . 0.0 110.286 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.17 -42.23 99.37 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.06 -18.05 51.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.695 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.4 tp -76.79 -43.75 35.52 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -69.26 -18.24 63.84 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.727 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.4 pttt 53.23 34.13 16.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.507 1.923 . . . . 0.0 112.289 177.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.3 p . . . . . 0 N--CA 1.414 -2.226 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.458 179.912 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.029 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -108.34 6.67 26.65 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.126 0.489 . . . . 0.0 111.329 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -93.58 55.82 2.28 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-O 123.073 1.416 . . . . 0.0 108.359 176.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -122.91 111.59 16.82 Favored 'General case' 0 N--CA 1.421 -1.902 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 176.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.9 147.12 34.2 Favored Pre-proline 0 C--N 1.28 -2.445 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -176.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -70.74 131.83 20.61 Favored 'Trans proline' 0 N--CA 1.434 -2.009 0 C-N-CA 121.19 1.26 . . . . 0.0 111.493 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.3 t -74.03 116.42 14.63 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.304 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.34 -25.38 34.54 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -88.68 -9.91 50.38 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.9 p -142.57 -15.63 0.73 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.89 -1.87 86.98 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.704 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.1 m -82.27 134.33 35.28 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 122.522 -0.399 . . . . 0.0 110.318 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -77.9 100.99 6.6 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.4 t -104.9 133.82 19.96 Favored Pre-proline 0 C--N 1.285 -2.206 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.174 -175.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -49.99 128.99 23.52 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 122.893 2.396 . . . . 0.0 111.13 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.9 p -48.52 -34.48 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.193 0 C-N-CA 124.948 1.299 . . . . 0.0 112.594 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 31.4 p90 -74.78 -16.93 60.7 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -98.74 -6.71 28.93 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 121.932 -0.48 . . . . 0.0 110.354 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.265 7.3 mmt -51.27 -57.55 13.69 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.97 -50.53 13.05 Favored 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.072 1.848 . . . . 0.0 111.325 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -54.57 -58.1 8.82 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.635 1.174 . . . . 0.0 113.177 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -63.28 -46.09 88.41 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.51 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.1 mmm -64.79 -36.35 84.05 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.257 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -69.61 -29.08 66.5 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.386 0.613 . . . . 0.0 110.122 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -63.55 -45.47 90.36 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.338 -0.846 . . . . 0.0 108.909 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -63.47 -41.69 98.6 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.191 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -54.51 -58.27 8.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 123.267 0.354 . . . . 0.0 111.633 -178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -67.45 -35.93 80.19 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.495 0.497 . . . . 0.0 111.604 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.4 tp -66.98 -49.65 64.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.481 0.658 . . . . 0.0 110.907 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -82.49 -13.56 56.48 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.749 -176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 62.0 tp -70.66 -12.84 61.81 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 174.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 70.4 mt-30 -82.64 -10.43 58.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.262 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -139.44 -34.08 0.59 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.7 p . . . . . 0 N--CA 1.426 -1.632 0 CA-C-O 118.654 -0.688 . . . . 0.0 109.578 179.318 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.755 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.81 -32.35 73.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.755 0.788 . . . . 0.0 109.099 177.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -121.0 30.74 6.71 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.815 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -123.55 111.16 15.94 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 172.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.5 m -110.29 138.21 20.82 Favored Pre-proline 0 C--N 1.275 -2.657 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 -175.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.54 130.71 25.74 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 C-N-CA 121.578 1.519 . . . . 0.0 111.303 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 t -73.93 123.86 25.07 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.441 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.483 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 23.7 mp0 -58.83 -33.49 70.46 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.631 0.729 . . . . 0.0 110.616 -176.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -83.22 -9.26 59.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -174.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 p -142.04 -20.29 0.72 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.04 1.21 88.8 Favored Glycine 0 C--N 1.31 -0.894 0 C-N-CA 121.134 -0.555 . . . . 0.0 112.44 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.7 m -85.99 138.93 31.62 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 122.458 -0.437 . . . . 0.0 110.246 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.9 mt -75.56 110.5 10.0 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 122.943 0.497 . . . . 0.0 110.017 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 43.1 t -111.13 132.38 21.74 Favored Pre-proline 0 C--N 1.285 -2.212 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.277 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -54.57 130.89 42.53 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.736 2.291 . . . . 0.0 109.933 173.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 p -46.95 -37.89 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.16 0.984 . . . . 0.0 113.463 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.4 p90 -77.26 -12.64 59.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.48 -6.52 33.58 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.5 mmt -51.41 -55.72 26.68 Favored Pre-proline 0 C--O 1.211 -0.928 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -53.18 -49.46 17.43 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 121.694 1.596 . . . . 0.0 111.087 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -53.57 -58.31 7.64 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.973 1.309 . . . . 0.0 111.539 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -65.81 -42.77 90.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.304 -175.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 93.9 mmm -70.12 -27.37 64.53 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.158 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.8 -36.68 75.86 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.89 -45.03 94.43 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.115 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -62.84 -41.08 99.2 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.695 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -57.79 -57.11 14.2 Favored 'General case' 0 N--CA 1.444 -0.731 0 O-C-N 123.578 0.549 . . . . 0.0 109.683 -174.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.18 93.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.173 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.19 -40.64 94.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 110.812 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HA ' ' OXT' ' A' ' 39' ' ' SER . 50.8 mt-10 -87.13 -8.44 56.98 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.44 0.638 . . . . 0.0 110.884 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.2 tp -86.13 -8.7 57.66 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.34 175.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -66.84 -37.4 84.41 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.524 0.678 . . . . 0.0 110.848 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -156.93 -50.11 0.07 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.471 ' OXT' ' HA ' ' A' ' 35' ' ' GLU . 54.3 m . . . . . 0 C--O 1.255 1.373 0 C-N-CA 128.647 2.779 . . . . 0.0 104.369 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.87 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 62.66 67.08 0.72 Allowed 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -170.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -93.51 12.63 24.47 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.123 -173.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -121.43 103.79 9.2 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 106.336 -1.728 . . . . 0.0 106.336 172.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.507 HG23 ' HE2' ' A' ' 24' ' ' MET . 18.5 m -116.99 134.78 22.95 Favored Pre-proline 0 C--N 1.276 -2.629 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.862 -174.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.98 129.38 20.59 Favored 'Trans proline' 0 N--CA 1.441 -1.604 0 C-N-CA 121.562 1.508 . . . . 0.0 110.642 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.3 t -72.83 114.91 11.49 Favored 'General case' 0 C--N 1.282 -2.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -52.04 -33.93 40.97 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.788 0.835 . . . . 0.0 111.461 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -80.99 -9.71 59.81 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -175.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.0 p -143.31 -21.17 0.62 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.34 -4.58 80.48 Favored Glycine 0 C--N 1.314 -0.688 0 C-N-CA 121.621 -0.323 . . . . 0.0 112.759 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -80.54 141.68 34.87 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.413 -0.463 . . . . 0.0 109.825 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 114.34 16.15 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.465 0.65 . . . . 0.0 109.703 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.9 t -115.0 133.06 22.71 Favored Pre-proline 0 C--N 1.29 -1.983 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.084 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.12 136.77 76.98 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.258 1.972 . . . . 0.0 110.157 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.6 p -49.52 -34.53 8.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 C-N-CA 124.003 0.921 . . . . 0.0 112.098 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -79.92 -10.28 59.76 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.45 -13.18 20.69 Favored 'General case' 0 CA--C 1.494 -1.189 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.507 ' HE2' HG23 ' A' ' 10' ' ' VAL . 7.3 mmt -50.93 -54.02 41.57 Favored Pre-proline 0 C--O 1.212 -0.877 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.7 -49.37 16.98 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 121.561 1.507 . . . . 0.0 111.428 176.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -54.14 -55.31 28.98 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 124.698 1.199 . . . . 0.0 111.453 177.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -68.75 -41.3 79.11 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.804 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 13.6 mmt -67.01 -34.82 78.58 Favored 'General case' 0 CA--C 1.485 -1.556 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.094 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.35 -34.44 77.72 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -62.05 -48.64 79.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.668 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 81.8 m-70 -64.29 -42.03 96.58 Favored 'General case' 0 C--O 1.193 -1.901 0 C-N-CA 119.901 -0.719 . . . . 0.0 110.464 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -57.44 -49.02 77.57 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 122.666 0.386 . . . . 0.0 111.358 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.459 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -65.24 -36.17 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.904 0.383 . . . . 0.0 110.326 177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 tp -65.87 -40.91 92.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.723 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 31' ' ' HIS . 50.2 mt-10 -77.9 -25.68 48.64 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 123.25 0.62 . . . . 0.0 109.699 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.585 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 52.5 tp -79.09 0.86 26.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.693 0.759 . . . . 0.0 110.018 -177.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 97.6 mt-30 -87.78 -18.53 29.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.84 175.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -135.64 34.06 2.96 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.255 0.55 . . . . 0.0 110.558 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.585 ' OG ' ' HA ' ' A' ' 36' ' ' LEU . 55.5 m . . . . . 0 C--N 1.305 -1.365 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.27 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 66.69 46.51 1.74 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.462 1.105 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -93.27 39.16 1.05 Allowed 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.958 0.885 . . . . 0.0 109.58 -177.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -125.15 105.73 9.37 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m -107.07 146.54 33.38 Favored Pre-proline 0 C--N 1.275 -2.645 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.47 -173.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.09 130.28 18.67 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.704 1.603 . . . . 0.0 112.082 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.7 t -74.16 117.31 15.81 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.756 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -52.22 -33.84 42.98 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.079 0.552 . . . . 0.0 112.446 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -82.12 -8.91 59.67 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 p -141.92 -25.15 0.68 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.24 -6.3 75.46 Favored Glycine 0 C--O 1.22 -0.729 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.092 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.3 m -79.99 139.06 37.16 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.7 mt -76.8 114.79 15.96 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.425 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 53.1 t -121.41 135.19 24.84 Favored Pre-proline 0 C--N 1.3 -1.565 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.148 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.17 130.14 36.77 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.889 2.392 . . . . 0.0 111.451 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.8 p -50.17 -34.93 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 124.19 0.996 . . . . 0.0 113.092 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -77.14 -17.89 58.28 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -100.74 -3.61 29.76 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.425 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -49.96 -57.92 11.05 Favored Pre-proline 0 N--CA 1.474 0.733 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -56.24 -43.18 58.56 Favored 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 121.89 1.727 . . . . 0.0 111.535 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -56.76 -55.68 31.11 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.882 1.273 . . . . 0.0 110.879 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.15 -44.66 91.46 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.131 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.52 ' O ' ' HD1' ' A' ' 32' ' ' PHE . 8.1 mmt -61.76 -37.09 83.0 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.586 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.93 -33.16 75.19 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 123.583 0.552 . . . . 0.0 109.692 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -62.23 -45.24 94.23 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.822 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -62.15 -41.98 98.82 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.266 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.52 ' HD1' ' O ' ' A' ' 28' ' ' MET . 17.1 m-85 -59.45 -58.04 10.35 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.98 69.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.896 0.379 . . . . 0.0 111.261 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 tp -69.58 -45.64 68.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.368 0.604 . . . . 0.0 110.229 177.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 43.7 mt-10 -86.95 -3.94 59.13 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.887 0.851 . . . . 0.0 111.571 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.9 tp -75.43 -16.85 60.3 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -87.97 -23.66 23.79 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.271 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 63.6 pttt -80.3 -17.0 53.36 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.456 0.646 . . . . 0.0 111.139 -174.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.299 -1.61 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.715 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.775 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 67.02 26.38 9.04 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 124.094 0.871 . . . . 0.0 111.165 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -93.81 15.18 17.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 122.615 1.198 . . . . 0.0 108.638 175.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -127.11 103.27 7.35 Favored 'General case' 0 N--CA 1.423 -1.823 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 169.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.3 141.47 22.6 Favored Pre-proline 0 C--N 1.281 -2.412 0 CA-C-O 120.677 0.275 . . . . 0.0 111.334 -173.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.22 124.79 12.12 Favored 'Trans proline' 0 N--CA 1.431 -2.178 0 C-N-CA 121.794 1.663 . . . . 0.0 111.954 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.8 t -71.71 117.35 13.18 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.267 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -57.47 -31.33 65.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 123.715 0.634 . . . . 0.0 110.76 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -81.94 -9.54 59.55 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.4 p -143.64 -21.18 0.59 Allowed 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 177.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.77 -2.36 76.5 Favored Glycine 0 C--N 1.313 -0.745 0 C-N-CA 121.496 -0.383 . . . . 0.0 113.384 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.82 140.43 34.19 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.3 mt -81.09 102.47 10.26 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 31.9 t -100.73 132.35 22.35 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.468 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.92 127.0 23.82 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.548 2.165 . . . . 0.0 110.734 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 p -50.64 -32.34 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 125.221 1.408 . . . . 0.0 113.031 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -74.12 -24.02 59.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 178.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -101.67 -0.48 34.54 Favored 'General case' 0 CA--C 1.492 -1.253 0 O-C-N 121.824 -0.547 . . . . 0.0 110.5 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 28' ' ' MET . 0.2 OUTLIER -51.77 -52.68 58.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 179.006 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -59.17 -44.84 31.2 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 121.53 1.486 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.45 -48.42 79.22 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 124.655 1.182 . . . . 0.0 111.316 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -65.46 -42.15 92.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.942 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 24' ' ' MET . 49.2 mtp -69.04 -29.82 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.768 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.13 -35.17 73.89 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -64.9 -45.88 84.04 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.833 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -65.16 -34.64 78.87 Favored 'General case' 0 C--O 1.2 -1.524 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.724 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -59.31 -56.14 25.88 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' A' ' 36' ' ' LEU . . . -64.58 -38.96 92.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.871 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 tp -63.92 -42.87 97.26 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-O 121.472 0.653 . . . . 0.0 110.922 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -83.68 -10.19 58.34 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.576 0.703 . . . . 0.0 110.401 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.5 tt -73.95 -31.26 62.94 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 172.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 90.0 mt-30 -80.12 -48.9 12.47 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 176.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt 51.2 33.73 10.06 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.652 1.581 . . . . 0.0 113.176 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.261 1.666 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.703 177.903 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.156 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 66.61 19.42 10.82 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.396 1.078 . . . . 0.0 111.681 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -122.0 20.28 10.76 Favored 'General case' 0 CA--C 1.488 -1.412 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.003 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -96.6 109.06 21.74 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.481 177.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.8 m -102.53 144.13 27.98 Favored Pre-proline 0 C--N 1.284 -2.245 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.09 125.06 11.56 Favored 'Trans proline' 0 N--CA 1.439 -1.706 0 C-N-CA 121.628 1.552 . . . . 0.0 111.983 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.9 t -72.55 117.55 14.36 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.918 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -55.24 -27.6 47.4 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 124.417 1.087 . . . . 0.0 113.22 -175.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 61.7 mttm -86.1 -9.56 56.47 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -140.83 -27.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -177.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.22 -7.29 75.83 Favored Glycine 0 C--N 1.308 -1.012 0 C-N-CA 121.273 -0.489 . . . . 0.0 111.945 -178.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 m -77.41 138.0 39.03 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.19 111.73 13.12 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.404 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 24.8 t -113.07 130.54 23.47 Favored Pre-proline 0 C--N 1.283 -2.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.869 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.64 128.88 31.25 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.487 2.125 . . . . 0.0 110.526 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.7 p -48.55 -34.35 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.403 0 C-N-CA 125.479 1.512 . . . . 0.0 112.676 -175.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -77.61 -15.38 59.25 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -100.12 -4.15 30.32 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.404 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -51.05 -58.27 10.97 Favored Pre-proline 0 C--O 1.208 -1.131 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.2 -46.17 35.83 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.124 1.883 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.93 -51.7 68.94 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 125.116 1.367 . . . . 0.0 112.152 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -64.55 -33.93 77.05 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.548 0.689 . . . . 0.0 109.804 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.427 ' HA ' ' CE ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -64.61 -36.46 84.32 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.413 175.135 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.8 -34.7 78.4 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.584 0.552 . . . . 0.0 109.882 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.52 -50.58 70.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.607 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -65.18 -36.69 84.99 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.307 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -56.48 -56.87 15.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -62.2 -46.46 88.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.735 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.8 tp -61.72 -42.76 99.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.591 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.434 ' OE2' ' HD3' ' A' ' 14' ' ' LYS . 47.0 mt-10 -82.4 -18.76 40.79 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.087 0.47 . . . . 0.0 110.803 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.0 tp -76.53 -22.65 54.1 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 28.0 mm-40 -63.28 -43.62 97.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.372 0.606 . . . . 0.0 109.739 178.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -90.77 23.25 3.18 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.403 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 C--O 1.256 1.414 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.653 179.099 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.878 0 CA-C-O 120.891 0.377 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -94.16 12.75 25.48 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 121.31 0.576 . . . . 0.0 110.896 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -93.4 56.69 2.49 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -132.71 115.84 15.86 Favored 'General case' 0 N--CA 1.422 -1.841 0 CA-C-N 113.231 -1.804 . . . . 0.0 106.329 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -103.19 143.04 25.81 Favored Pre-proline 0 C--N 1.283 -2.311 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.07 124.82 12.69 Favored 'Trans proline' 0 N--CA 1.436 -1.87 0 C-N-CA 121.084 1.189 . . . . 0.0 110.158 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.4 t -74.19 110.67 8.67 Favored 'General case' 0 C--N 1.275 -2.652 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.169 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -46.88 -34.03 5.06 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -80.9 -8.99 59.87 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.7 p -142.67 -23.22 0.65 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.88 -7.74 76.67 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.074 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.3 m -78.89 138.69 38.24 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.52 103.85 7.7 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.8 t -106.1 129.02 25.23 Favored Pre-proline 0 C--N 1.283 -2.312 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.353 -175.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.45 130.88 26.54 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.97 2.447 . . . . 0.0 111.291 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.0 p -51.96 -37.64 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.624 -175.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.8 p90 -75.85 -13.24 60.27 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -101.11 -1.12 34.87 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.256 8.6 mmt -52.53 -52.57 62.43 Favored Pre-proline 0 C--O 1.216 -0.701 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -50.85 -53.12 7.69 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.875 1.717 . . . . 0.0 111.161 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.28 -55.85 24.22 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 124.915 1.286 . . . . 0.0 112.077 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -67.54 -41.87 83.59 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.745 -176.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.3 mmm -69.59 -29.27 66.76 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.665 -0.647 . . . . 0.0 111.276 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.89 -29.87 67.17 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -64.9 -47.12 78.95 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.416 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.4 m-70 -65.37 -38.87 91.36 Favored 'General case' 0 C--O 1.195 -1.764 0 C-N-CA 119.59 -0.844 . . . . 0.0 110.718 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -58.72 -53.29 59.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.722 0.237 . . . . 0.0 111.601 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -61.62 -40.95 96.66 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.968 178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 35.1 tp -63.12 -42.14 99.47 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.456 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.421 ' HA ' ' HE3' ' A' ' 38' ' ' LYS . 46.4 mt-10 -72.42 -28.85 63.23 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.52 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.8 tp -77.28 -25.76 51.7 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.478 0.656 . . . . 0.0 109.532 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.1 mm100 -82.44 -32.41 29.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.684 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -100.06 -22.89 15.04 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -177.019 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--N 1.311 -1.102 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.738 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 121.848 0.832 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -104.2 18.94 21.08 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.293 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -94.53 10.82 33.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.934 0.873 . . . . 0.0 109.695 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -131.52 118.58 20.35 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 170.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.6 m -119.34 143.8 35.13 Favored Pre-proline 0 C--N 1.28 -2.423 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.97 130.62 16.93 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 120.973 1.116 . . . . 0.0 110.21 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.3 t -72.55 110.99 7.32 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.75 -22.73 15.02 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -81.51 -26.41 35.15 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -128.63 -19.14 3.79 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.94 -3.18 85.94 Favored Glycine 0 C--N 1.306 -1.101 0 C-N-CA 121.347 -0.454 . . . . 0.0 112.951 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -79.71 144.68 33.46 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.61 115.01 21.39 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.355 0.598 . . . . 0.0 109.948 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.655 ' HB ' ' SD ' ' A' ' 24' ' ' MET . 28.4 t -113.49 136.19 21.92 Favored Pre-proline 0 C--N 1.291 -1.95 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.482 -177.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -59.26 141.07 97.36 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.021 1.814 . . . . 0.0 110.61 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.5 p -53.83 -34.44 25.26 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 C-N-CA 123.781 0.833 . . . . 0.0 111.361 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -77.6 -19.3 55.79 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -97.61 -7.45 31.09 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.977 -0.452 . . . . 0.0 110.724 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.655 ' SD ' ' HB ' ' A' ' 19' ' ' VAL . 87.7 mmm -51.15 -55.77 25.55 Favored Pre-proline 0 C--N 1.316 -0.854 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -55.49 -45.91 36.16 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.944 1.763 . . . . 0.0 111.129 178.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.63 -53.83 49.62 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 125.327 1.451 . . . . 0.0 110.055 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -66.79 -40.92 88.32 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.542 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 97.3 mmm -69.06 -28.05 66.19 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.836 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -72.59 -30.03 64.02 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.724 0.774 . . . . 0.0 108.925 178.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.9 -47.08 79.06 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.235 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.468 ' HB3' ' OE2' ' A' ' 35' ' ' GLU . 87.6 m-70 -66.91 -33.33 75.35 Favored 'General case' 0 C--O 1.191 -1.976 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.044 177.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -59.62 -51.54 69.38 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -176.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -62.17 -47.83 82.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.095 177.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.46 -36.93 74.45 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.449 0.699 . . . . 0.0 111.64 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' OE2' ' HB3' ' A' ' 31' ' ' HIS . 43.1 mt-10 -83.85 -21.15 32.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 123.439 0.696 . . . . 0.0 111.8 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -76.45 -33.13 58.75 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 17.1 mm-40 -80.78 -7.24 59.34 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.414 174.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 pttp 62.54 -21.11 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 129.148 2.979 . . . . 0.0 115.414 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 CA--C 1.545 0.781 0 C-N-CA 124.08 0.952 . . . . 0.0 109.329 -174.91 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.468 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -86.4 -50.93 6.54 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -175.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -116.15 17.3 15.8 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.211 0.529 . . . . 0.0 110.923 -176.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 6' ' ' ALA . 50.9 mt-30 -121.76 117.91 27.76 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 176.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -120.91 129.29 25.37 Favored Pre-proline 0 C--N 1.292 -1.897 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.135 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.76 124.22 11.66 Favored 'Trans proline' 0 N--CA 1.438 -1.754 0 C-N-CA 121.367 1.378 . . . . 0.0 111.335 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 19' ' ' VAL . 43.7 t -74.76 112.83 11.36 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.93 178.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.45 -30.17 60.02 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 124.097 0.959 . . . . 0.0 111.664 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -78.71 -9.67 59.49 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.4 p -143.53 -22.89 0.6 Allowed 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.84 7.61 83.78 Favored Glycine 0 C--N 1.305 -1.144 0 C-N-CA 121.601 -0.333 . . . . 0.0 113.117 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -89.21 144.6 25.99 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.07 106.3 13.86 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.443 ' CG2' ' HB2' ' A' ' 12' ' ' CYS . 46.8 t -92.12 133.67 29.85 Favored Pre-proline 0 C--N 1.279 -2.483 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.742 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.95 126.87 18.16 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 122.144 1.896 . . . . 0.0 109.327 174.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.1 p -47.01 -40.0 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.591 0 C-N-CA 124.488 1.115 . . . . 0.0 113.457 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.4 p90 -66.77 -28.59 68.52 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -106.22 4.78 29.24 Favored 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 121.557 -0.714 . . . . 0.0 111.166 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -53.11 58.91 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.5 -41.58 39.42 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 121.651 1.567 . . . . 0.0 111.127 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -58.19 -48.94 78.77 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.67 1.188 . . . . 0.0 110.618 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -65.28 -42.4 93.2 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.588 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.21 -35.53 80.61 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.001 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -66.48 -34.73 78.59 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 123.764 0.665 . . . . 0.0 110.471 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -63.07 -42.77 99.75 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -63.55 -39.75 95.22 Favored 'General case' 0 C--O 1.194 -1.859 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.534 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.24 -50.91 72.18 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 120.411 0.148 . . . . 0.0 111.31 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -64.57 -42.14 95.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.255 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -62.53 -42.4 99.5 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.013 0.925 . . . . 0.0 111.074 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 52.2 mt-10 -75.4 -20.87 58.67 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.338 178.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.6 tp -83.95 -12.37 55.45 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 28.8 mm-40 -74.75 -2.19 25.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 24.3 pttm -84.77 -9.47 58.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.417 0.627 . . . . 0.0 110.216 176.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.428 -1.525 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.781 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.94 52.27 2.42 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.751 0.786 . . . . 0.0 109.428 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -137.96 72.42 1.41 Allowed 'General case' 0 C--O 1.248 0.977 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.767 -175.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.481 ' HG2' ' HA ' ' A' ' 20' ' ' PRO . 68.1 mt-30 -128.38 156.68 42.74 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.9 m -135.06 138.95 30.56 Favored Pre-proline 0 C--N 1.296 -1.744 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.27 124.95 11.36 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 121.091 1.194 . . . . 0.0 110.885 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.2 t -74.86 111.9 10.54 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.222 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -50.01 -33.27 17.51 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.435 1.094 . . . . 0.0 112.572 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -79.35 -9.4 59.58 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.9 p -142.95 -20.99 0.64 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.46 0.33 86.55 Favored Glycine 0 C--O 1.217 -0.934 0 C-N-CA 121.707 -0.282 . . . . 0.0 112.399 -177.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -82.74 139.43 33.62 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.53 106.79 10.72 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 54.3 t -100.81 132.47 22.12 Favored Pre-proline 0 C--N 1.293 -1.873 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.818 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.481 ' HA ' ' HG2' ' A' ' 9' ' ' GLN . 45.4 Cg_exo -56.7 133.75 60.0 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.003 2.468 . . . . 0.0 110.772 175.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.0 p -52.97 -35.42 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.139 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.0 p90 -74.57 -23.53 58.77 Favored 'General case' 0 CA--C 1.55 0.981 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -105.51 3.23 29.2 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.263 -0.898 . . . . 0.0 110.75 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.96 -54.64 35.17 Favored Pre-proline 0 CA--C 1.563 1.448 0 C-N-CA 123.713 0.805 . . . . 0.0 111.895 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.07 -43.02 32.14 Favored 'Trans proline' 0 C--N 1.385 2.484 0 C-N-CA 121.904 1.736 . . . . 0.0 111.698 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -54.96 -51.87 64.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.484 1.113 . . . . 0.0 110.693 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.9 t60 -66.23 -40.42 90.24 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.863 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.2 mmm -68.26 -29.08 67.79 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.859 177.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -72.18 -31.47 65.95 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -63.77 -48.72 75.82 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.416 176.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -64.41 -37.16 86.56 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.182 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -63.07 -55.21 27.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.501 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -61.55 -34.16 75.09 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 123.162 0.585 . . . . 0.0 111.01 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 tp -68.03 -42.9 79.93 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.518 0.511 . . . . 0.0 110.368 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -86.11 -16.75 37.02 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.259 0.552 . . . . 0.0 110.777 -176.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.2 tp -82.18 -5.83 58.76 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.812 0.815 . . . . 0.0 109.397 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 98.2 mt-30 -73.7 -16.43 61.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.293 62.0 pttt 53.42 2.54 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 127.835 2.454 . . . . 0.0 116.905 175.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.415 -2.22 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.052 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' C ' ' H ' ' A' ' 8' ' ' ASP . . . . . . . . 0 CA--C 1.504 -0.79 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.08 33.77 0.13 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.469 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.507 ' H ' ' C ' ' A' ' 6' ' ' ALA . 2.4 m-20 -98.42 63.25 1.5 Allowed 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 104.061 -2.57 . . . . 0.0 104.061 -178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.22 144.9 51.16 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.533 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG23 ' SD ' ' A' ' 24' ' ' MET . 13.5 m -133.16 136.43 27.41 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -66.91 122.15 9.45 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 121.804 1.669 . . . . 0.0 111.42 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.2 t -74.27 115.06 13.35 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.154 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.56 -35.8 42.59 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.739 0.816 . . . . 0.0 112.381 -177.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -76.36 -9.31 58.55 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -173.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.1 p -143.42 -25.7 0.58 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.5 -1.04 75.32 Favored Glycine 0 C--N 1.312 -0.764 0 C-N-CA 121.592 -0.337 . . . . 0.0 113.125 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -80.45 137.91 36.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.279 0.54 . . . . 0.0 109.746 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.33 103.79 6.52 Favored 'General case' 0 CA--C 1.498 -1.039 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.9 t -98.45 134.94 21.38 Favored Pre-proline 0 C--N 1.281 -2.37 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.932 -176.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.09 128.56 27.51 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.612 2.208 . . . . 0.0 109.767 174.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -50.64 -37.95 16.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 124.888 1.275 . . . . 0.0 112.53 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -69.97 -30.37 67.7 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -91.8 -0.12 57.51 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.826 -0.546 . . . . 0.0 111.185 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.425 ' SD ' HG23 ' A' ' 10' ' ' VAL 0.256 0.0 OUTLIER -51.47 -58.48 10.63 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.334 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.01 -45.22 37.55 Favored 'Trans proline' 0 C--N 1.369 1.637 0 C-N-CA 121.948 1.765 . . . . 0.0 111.157 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -54.03 -53.27 55.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.326 1.05 . . . . 0.0 110.858 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -65.99 -38.9 89.7 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 124.182 0.993 . . . . 0.0 110.872 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.5 mtp -68.03 -29.67 68.71 Favored 'General case' 0 C--O 1.203 -1.359 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.402 176.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.15 -32.16 70.01 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -62.99 -45.87 90.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.106 174.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -65.58 -35.6 81.29 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.874 -0.73 . . . . 0.0 109.957 176.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -60.06 -56.35 22.7 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -176.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.17 90.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.995 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 tp -65.53 -41.05 93.51 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.14 -17.05 51.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.166 0.507 . . . . 0.0 109.921 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.7 tp -87.21 -12.46 46.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.756 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -55.85 -52.03 65.46 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -107.13 -3.48 19.87 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.247 0.939 0 C-N-CA 125.05 1.34 . . . . 0.0 110.641 179.904 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.422 -1.866 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.04 125.65 13.37 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 121.19 1.26 . . . . 0.0 112.147 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -74.4 111.59 9.74 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.728 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.15 -23.23 33.42 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 124.085 0.954 . . . . 0.0 113.168 -175.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -82.39 -18.18 42.89 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.3 p -135.07 -27.88 1.21 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.53 -5.24 64.62 Favored Glycine 0 C--N 1.308 -0.973 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.274 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.1 m -76.79 138.12 39.68 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.0 mt -79.04 106.08 10.82 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -108.52 131.4 21.79 Favored Pre-proline 0 C--N 1.288 -2.066 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.636 -174.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.13 127.99 25.55 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.838 2.359 . . . . 0.0 111.212 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.4 p -48.94 -38.53 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 125.464 1.505 . . . . 0.0 112.673 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 38.2 p90 -73.16 -17.17 61.41 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -98.31 -3.43 37.21 Favored 'General case' 0 CA--C 1.489 -1.4 0 O-C-N 122.302 -0.249 . . . . 0.0 110.587 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.42 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.4 mmt -52.41 -49.8 83.41 Favored Pre-proline 0 C--O 1.211 -0.96 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' MET . 9.4 Cg_endo -57.1 -49.07 15.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 121.546 1.497 . . . . 0.0 111.035 177.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -58.01 -50.33 73.77 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 124.616 1.167 . . . . 0.0 112.518 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -68.42 -41.99 79.58 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.292 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 89.5 mmm -66.36 -33.58 76.05 Favored 'General case' 0 CA--C 1.491 -1.298 0 O-C-N 121.883 -0.511 . . . . 0.0 110.847 177.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -67.69 -31.3 71.17 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.413 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -67.81 -40.26 83.86 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.728 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -66.47 -32.2 73.42 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.957 175.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -59.65 -57.96 10.67 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.99 -48.49 78.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.059 0.457 . . . . 0.0 111.234 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.4 tp . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.184 -177.638 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.402 HG23 ' HE2' ' A' ' 24' ' ' MET . 29.1 m . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.8 130.39 21.77 Favored 'Trans proline' 0 N--CA 1.435 -1.951 0 C-N-CA 121.403 1.402 . . . . 0.0 111.287 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.5 t -73.5 123.17 23.39 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.669 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 35.4 mp0 -56.52 -35.86 68.53 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 123.848 0.859 . . . . 0.0 110.879 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -83.19 -9.31 59.24 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -142.75 -23.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.41 -1.52 76.42 Favored Glycine 0 C--N 1.312 -0.783 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.37 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.5 m -81.03 138.42 36.01 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.45 109.91 10.56 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.2 t -112.47 127.89 26.26 Favored Pre-proline 0 C--N 1.294 -1.839 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.0 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -50.3 133.6 36.65 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.318 2.678 . . . . 0.0 111.676 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.2 p -48.96 -35.87 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 124.756 1.223 . . . . 0.0 112.985 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -79.52 -12.35 59.87 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -103.59 -4.8 23.39 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 121.742 -0.598 . . . . 0.0 110.564 177.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 10' ' ' VAL . 4.4 mmt -50.1 -55.53 23.99 Favored Pre-proline 0 N--CA 1.467 0.399 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.78 -47.36 27.63 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.857 1.705 . . . . 0.0 111.247 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.15 -51.78 67.95 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 124.381 1.072 . . . . 0.0 112.259 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -67.19 -43.51 81.96 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.771 -178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.5 mmm -68.17 -28.13 67.02 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 121.897 -0.502 . . . . 0.0 111.149 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -67.79 -37.93 82.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -62.02 -47.41 84.88 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -63.68 -39.26 93.89 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.854 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.47 -56.74 17.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.896 0.748 . . . . 0.0 109.683 -175.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.89 -38.73 86.83 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.447 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 C--O 1.238 0.48 0 CA-C-O 121.255 0.55 . . . . 0.0 111.118 -178.314 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.432 -1.366 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.19 122.77 9.32 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 121.748 1.632 . . . . 0.0 112.866 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 14.8 t -65.85 120.62 13.37 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 123.887 0.875 . . . . 0.0 109.699 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.85 -22.73 62.68 Favored 'General case' 0 C--N 1.301 -1.527 0 C-N-CA 123.397 0.679 . . . . 0.0 112.819 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.67 -9.32 38.27 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.8 -10.94 0.9 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.59 -5.19 75.31 Favored Glycine 0 C--N 1.312 -0.788 0 C-N-CA 121.017 -0.611 . . . . 0.0 113.178 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.1 m -79.83 138.81 37.31 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 122.487 0.315 . . . . 0.0 110.294 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.5 mt -78.17 100.88 6.79 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.601 0.715 . . . . 0.0 109.195 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.3 t -104.67 133.34 20.23 Favored Pre-proline 0 C--N 1.282 -2.357 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.54 -174.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.19 128.33 28.68 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.367 2.045 . . . . 0.0 110.223 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.23 -35.21 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 C-N-CA 124.467 1.107 . . . . 0.0 112.627 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -75.27 -10.6 59.61 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -102.25 -9.1 20.72 Favored 'General case' 0 CA--C 1.503 -0.863 0 C-N-CA 122.829 0.451 . . . . 0.0 110.203 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.3 mmt -50.05 -55.14 26.4 Favored Pre-proline 0 N--CA 1.472 0.634 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -54.25 -50.04 14.91 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 121.998 1.799 . . . . 0.0 111.616 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -62.4 -46.42 88.69 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 124.226 1.01 . . . . 0.0 112.753 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -66.13 -46.4 77.65 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 123.084 0.554 . . . . 0.0 111.187 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.7 mmm -66.26 -29.5 69.75 Favored 'General case' 0 C--N 1.311 -1.08 0 O-C-N 121.878 -0.514 . . . . 0.0 110.528 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.39 -32.68 73.75 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.839 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -66.49 -45.58 79.15 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.674 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -66.36 -33.31 75.45 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.426 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -62.65 -58.43 7.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.58 -28.9 68.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.743 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.264 0.554 . . . . 0.0 110.601 179.034 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.434 -1.267 0 CA-C-O 120.627 0.251 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.54 124.63 12.67 Favored 'Trans proline' 0 N--CA 1.44 -1.664 0 C-N-CA 121.76 1.64 . . . . 0.0 111.316 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -70.84 117.41 12.31 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.43 -30.72 67.12 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -79.97 -8.89 59.58 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -142.33 -26.03 0.64 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.44 -9.33 69.29 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.945 -0.645 . . . . 0.0 113.045 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -74.88 138.93 42.78 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.06 103.37 7.95 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 49.3 t -108.0 133.61 20.43 Favored Pre-proline 0 C--N 1.294 -1.814 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.307 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.03 137.85 82.93 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.932 2.421 . . . . 0.0 112.112 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.5 p -50.73 -36.44 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 124.745 1.218 . . . . 0.0 112.399 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.8 p90 -71.23 -22.0 62.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.0 -11.31 36.37 Favored 'General case' 0 CA--C 1.491 -1.312 0 O-C-N 122.423 -0.173 . . . . 0.0 110.67 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.257 9.2 mmt -49.39 -56.34 16.88 Favored Pre-proline 0 C--O 1.219 -0.519 0 N-CA-C 116.254 1.946 . . . . 0.0 116.254 -174.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.67 -53.53 5.96 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.872 1.715 . . . . 0.0 111.511 179.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -55.37 -49.9 71.08 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.236 1.014 . . . . 0.0 112.186 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -66.9 -44.6 80.4 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.334 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 67.3 mtp -65.22 -36.18 83.37 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.766 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -70.96 -30.41 66.69 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.153 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 93.8 t80 -64.49 -40.44 95.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -63.86 -39.63 94.67 Favored 'General case' 0 C--O 1.202 -1.441 0 C-N-CA 120.276 -0.569 . . . . 0.0 110.151 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -56.7 -49.45 75.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 123.124 0.265 . . . . 0.0 111.605 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.24 -40.57 96.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.154 0.502 . . . . 0.0 110.286 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp . . . . . 0 C--N 1.319 -0.725 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 -178.76 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.433 -1.319 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -70.74 131.83 20.61 Favored 'Trans proline' 0 N--CA 1.434 -2.009 0 C-N-CA 121.19 1.26 . . . . 0.0 111.493 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.3 t -74.03 116.42 14.63 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.304 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.34 -25.38 34.54 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -88.68 -9.91 50.38 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.9 p -142.57 -15.63 0.73 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.89 -1.87 86.98 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.704 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.1 m -82.27 134.33 35.28 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 122.522 -0.399 . . . . 0.0 110.318 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -77.9 100.99 6.6 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.4 t -104.9 133.82 19.96 Favored Pre-proline 0 C--N 1.285 -2.206 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.174 -175.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -49.99 128.99 23.52 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 122.893 2.396 . . . . 0.0 111.13 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.9 p -48.52 -34.48 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.193 0 C-N-CA 124.948 1.299 . . . . 0.0 112.594 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 31.4 p90 -74.78 -16.93 60.7 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -98.74 -6.71 28.93 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 121.932 -0.48 . . . . 0.0 110.354 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.265 7.3 mmt -51.27 -57.55 13.69 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.97 -50.53 13.05 Favored 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.072 1.848 . . . . 0.0 111.325 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -54.57 -58.1 8.82 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.635 1.174 . . . . 0.0 113.177 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -63.28 -46.09 88.41 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.51 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.1 mmm -64.79 -36.35 84.05 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.257 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -69.61 -29.08 66.5 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.386 0.613 . . . . 0.0 110.122 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -63.55 -45.47 90.36 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.338 -0.846 . . . . 0.0 108.909 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -63.47 -41.69 98.6 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.191 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -54.51 -58.27 8.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 123.267 0.354 . . . . 0.0 111.633 -178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.45 -35.93 80.19 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.495 0.497 . . . . 0.0 111.604 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.481 0.658 . . . . 0.0 110.907 -178.605 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.5 m . . . . . 0 N--CA 1.422 -1.853 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.54 130.71 25.74 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 C-N-CA 121.578 1.519 . . . . 0.0 111.303 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 t -73.93 123.86 25.07 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.441 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.483 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 23.7 mp0 -58.83 -33.49 70.46 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.631 0.729 . . . . 0.0 110.616 -176.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -83.22 -9.26 59.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -174.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 p -142.04 -20.29 0.72 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.04 1.21 88.8 Favored Glycine 0 C--N 1.31 -0.894 0 C-N-CA 121.134 -0.555 . . . . 0.0 112.44 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.7 m -85.99 138.93 31.62 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 122.458 -0.437 . . . . 0.0 110.246 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.9 mt -75.56 110.5 10.0 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 122.943 0.497 . . . . 0.0 110.017 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 43.1 t -111.13 132.38 21.74 Favored Pre-proline 0 C--N 1.285 -2.212 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.277 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -54.57 130.89 42.53 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.736 2.291 . . . . 0.0 109.933 173.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 p -46.95 -37.89 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.16 0.984 . . . . 0.0 113.463 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.4 p90 -77.26 -12.64 59.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.48 -6.52 33.58 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.5 mmt -51.41 -55.72 26.68 Favored Pre-proline 0 C--O 1.211 -0.928 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -53.18 -49.46 17.43 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 121.694 1.596 . . . . 0.0 111.087 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -53.57 -58.31 7.64 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.973 1.309 . . . . 0.0 111.539 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -65.81 -42.77 90.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.304 -175.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 93.9 mmm -70.12 -27.37 64.53 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.158 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.8 -36.68 75.86 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.89 -45.03 94.43 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.115 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -62.84 -41.08 99.2 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.695 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -57.79 -57.11 14.2 Favored 'General case' 0 N--CA 1.444 -0.731 0 O-C-N 123.578 0.549 . . . . 0.0 109.683 -174.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.18 93.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.173 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 110.812 -179.654 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.507 HG23 ' HE2' ' A' ' 24' ' ' MET . 18.5 m . . . . . 0 N--CA 1.431 -1.387 0 CA-C-O 120.634 0.254 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.98 129.38 20.59 Favored 'Trans proline' 0 N--CA 1.441 -1.604 0 C-N-CA 121.562 1.508 . . . . 0.0 110.642 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.3 t -72.83 114.91 11.49 Favored 'General case' 0 C--N 1.282 -2.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -52.04 -33.93 40.97 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.788 0.835 . . . . 0.0 111.461 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -80.99 -9.71 59.81 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -175.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.0 p -143.31 -21.17 0.62 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.34 -4.58 80.48 Favored Glycine 0 C--N 1.314 -0.688 0 C-N-CA 121.621 -0.323 . . . . 0.0 112.759 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -80.54 141.68 34.87 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.413 -0.463 . . . . 0.0 109.825 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 114.34 16.15 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.465 0.65 . . . . 0.0 109.703 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.9 t -115.0 133.06 22.71 Favored Pre-proline 0 C--N 1.29 -1.983 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.084 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.12 136.77 76.98 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.258 1.972 . . . . 0.0 110.157 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.6 p -49.52 -34.53 8.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 C-N-CA 124.003 0.921 . . . . 0.0 112.098 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -79.92 -10.28 59.76 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.45 -13.18 20.69 Favored 'General case' 0 CA--C 1.494 -1.189 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.507 ' HE2' HG23 ' A' ' 10' ' ' VAL . 7.3 mmt -50.93 -54.02 41.57 Favored Pre-proline 0 C--O 1.212 -0.877 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.7 -49.37 16.98 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 121.561 1.507 . . . . 0.0 111.428 176.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -54.14 -55.31 28.98 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 124.698 1.199 . . . . 0.0 111.453 177.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -68.75 -41.3 79.11 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.804 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 13.6 mmt -67.01 -34.82 78.58 Favored 'General case' 0 CA--C 1.485 -1.556 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.094 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.35 -34.44 77.72 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -62.05 -48.64 79.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.668 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -64.29 -42.03 96.58 Favored 'General case' 0 C--O 1.193 -1.901 0 C-N-CA 119.901 -0.719 . . . . 0.0 110.464 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -57.44 -49.02 77.57 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 122.666 0.386 . . . . 0.0 111.358 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.17 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.904 0.383 . . . . 0.0 110.326 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 tp . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.723 178.923 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.09 130.28 18.67 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.704 1.603 . . . . 0.0 112.082 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.7 t -74.16 117.31 15.81 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.756 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -52.22 -33.84 42.98 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.079 0.552 . . . . 0.0 112.446 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -82.12 -8.91 59.67 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 p -141.92 -25.15 0.68 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.24 -6.3 75.46 Favored Glycine 0 C--O 1.22 -0.729 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.092 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.3 m -79.99 139.06 37.16 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.7 mt -76.8 114.79 15.96 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.425 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 53.1 t -121.41 135.19 24.84 Favored Pre-proline 0 C--N 1.3 -1.565 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.148 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.17 130.14 36.77 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.889 2.392 . . . . 0.0 111.451 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.8 p -50.17 -34.93 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 124.19 0.996 . . . . 0.0 113.092 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -77.14 -17.89 58.28 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -100.74 -3.61 29.76 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.425 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -49.96 -57.92 11.05 Favored Pre-proline 0 N--CA 1.474 0.733 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -56.24 -43.18 58.56 Favored 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 121.89 1.727 . . . . 0.0 111.535 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -56.76 -55.68 31.11 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.882 1.273 . . . . 0.0 110.879 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.15 -44.66 91.46 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.131 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.52 ' O ' ' HD1' ' A' ' 32' ' ' PHE . 8.1 mmt -61.76 -37.09 83.0 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.586 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.93 -33.16 75.19 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 123.583 0.552 . . . . 0.0 109.692 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -62.23 -45.24 94.23 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.822 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -62.15 -41.98 98.82 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.266 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.52 ' HD1' ' O ' ' A' ' 28' ' ' MET . 17.1 m-85 -59.45 -58.04 10.35 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.98 69.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.896 0.379 . . . . 0.0 111.261 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.368 0.604 . . . . 0.0 110.229 177.255 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.435 -1.196 0 CA-C-O 120.677 0.275 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.22 124.79 12.12 Favored 'Trans proline' 0 N--CA 1.431 -2.178 0 C-N-CA 121.794 1.663 . . . . 0.0 111.954 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.8 t -71.71 117.35 13.18 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.267 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -57.47 -31.33 65.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 123.715 0.634 . . . . 0.0 110.76 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -81.94 -9.54 59.55 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.4 p -143.64 -21.18 0.59 Allowed 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 177.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.77 -2.36 76.5 Favored Glycine 0 C--N 1.313 -0.745 0 C-N-CA 121.496 -0.383 . . . . 0.0 113.384 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.82 140.43 34.19 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.3 mt -81.09 102.47 10.26 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 31.9 t -100.73 132.35 22.35 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.468 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.92 127.0 23.82 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.548 2.165 . . . . 0.0 110.734 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 p -50.64 -32.34 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 125.221 1.408 . . . . 0.0 113.031 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -74.12 -24.02 59.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 178.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -101.67 -0.48 34.54 Favored 'General case' 0 CA--C 1.492 -1.253 0 O-C-N 121.824 -0.547 . . . . 0.0 110.5 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 28' ' ' MET . 0.2 OUTLIER -51.77 -52.68 58.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 179.006 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -59.17 -44.84 31.2 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 121.53 1.486 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.45 -48.42 79.22 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 124.655 1.182 . . . . 0.0 111.316 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -65.46 -42.15 92.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.942 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 24' ' ' MET . 49.2 mtp -69.04 -29.82 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.768 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.13 -35.17 73.89 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -64.9 -45.88 84.04 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.833 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -65.16 -34.64 78.87 Favored 'General case' 0 C--O 1.2 -1.524 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.724 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -59.31 -56.14 25.88 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.58 -38.96 92.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.871 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 tp . . . . . 0 CA--C 1.549 0.912 0 CA-C-O 121.472 0.653 . . . . 0.0 110.922 179.843 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.428 -1.558 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.09 125.06 11.56 Favored 'Trans proline' 0 N--CA 1.439 -1.706 0 C-N-CA 121.628 1.552 . . . . 0.0 111.983 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.9 t -72.55 117.55 14.36 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.918 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -55.24 -27.6 47.4 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 124.417 1.087 . . . . 0.0 113.22 -175.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -86.1 -9.56 56.47 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -140.83 -27.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -177.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.22 -7.29 75.83 Favored Glycine 0 C--N 1.308 -1.012 0 C-N-CA 121.273 -0.489 . . . . 0.0 111.945 -178.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 m -77.41 138.0 39.03 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.19 111.73 13.12 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.404 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 24.8 t -113.07 130.54 23.47 Favored Pre-proline 0 C--N 1.283 -2.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.869 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.64 128.88 31.25 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.487 2.125 . . . . 0.0 110.526 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.7 p -48.55 -34.35 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.403 0 C-N-CA 125.479 1.512 . . . . 0.0 112.676 -175.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -77.61 -15.38 59.25 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -100.12 -4.15 30.32 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.404 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -51.05 -58.27 10.97 Favored Pre-proline 0 C--O 1.208 -1.131 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.2 -46.17 35.83 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.124 1.883 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.93 -51.7 68.94 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 125.116 1.367 . . . . 0.0 112.152 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -64.55 -33.93 77.05 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.548 0.689 . . . . 0.0 109.804 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.427 ' HA ' ' CE ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -64.61 -36.46 84.32 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.413 175.135 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.8 -34.7 78.4 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.584 0.552 . . . . 0.0 109.882 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.52 -50.58 70.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.607 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -65.18 -36.69 84.99 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.307 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -56.48 -56.87 15.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.46 88.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.735 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.591 -176.832 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.427 -1.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.07 124.82 12.69 Favored 'Trans proline' 0 N--CA 1.436 -1.87 0 C-N-CA 121.084 1.189 . . . . 0.0 110.158 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.4 t -74.19 110.67 8.67 Favored 'General case' 0 C--N 1.275 -2.652 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.169 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -46.88 -34.03 5.06 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -80.9 -8.99 59.87 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.7 p -142.67 -23.22 0.65 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.88 -7.74 76.67 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.074 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.3 m -78.89 138.69 38.24 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.52 103.85 7.7 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.8 t -106.1 129.02 25.23 Favored Pre-proline 0 C--N 1.283 -2.312 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.353 -175.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.45 130.88 26.54 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.97 2.447 . . . . 0.0 111.291 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.0 p -51.96 -37.64 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.624 -175.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.8 p90 -75.85 -13.24 60.27 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -101.11 -1.12 34.87 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.256 8.6 mmt -52.53 -52.57 62.43 Favored Pre-proline 0 C--O 1.216 -0.701 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -50.85 -53.12 7.69 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.875 1.717 . . . . 0.0 111.161 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.28 -55.85 24.22 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 124.915 1.286 . . . . 0.0 112.077 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -67.54 -41.87 83.59 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.745 -176.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.3 mmm -69.59 -29.27 66.76 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.665 -0.647 . . . . 0.0 111.276 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.89 -29.87 67.17 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -64.9 -47.12 78.95 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.416 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.4 m-70 -65.37 -38.87 91.36 Favored 'General case' 0 C--O 1.195 -1.764 0 C-N-CA 119.59 -0.844 . . . . 0.0 110.718 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -58.72 -53.29 59.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.722 0.237 . . . . 0.0 111.601 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.62 -40.95 96.66 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.968 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 35.1 tp . . . . . 0 CA--C 1.537 0.479 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.456 -179.075 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.6 m . . . . . 0 N--CA 1.428 -1.562 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.97 130.62 16.93 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 120.973 1.116 . . . . 0.0 110.21 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.3 t -72.55 110.99 7.32 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.75 -22.73 15.02 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -81.51 -26.41 35.15 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -128.63 -19.14 3.79 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.94 -3.18 85.94 Favored Glycine 0 C--N 1.306 -1.101 0 C-N-CA 121.347 -0.454 . . . . 0.0 112.951 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -79.71 144.68 33.46 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.61 115.01 21.39 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.355 0.598 . . . . 0.0 109.948 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.655 ' HB ' ' SD ' ' A' ' 24' ' ' MET . 28.4 t -113.49 136.19 21.92 Favored Pre-proline 0 C--N 1.291 -1.95 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.482 -177.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -59.26 141.07 97.36 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.021 1.814 . . . . 0.0 110.61 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.5 p -53.83 -34.44 25.26 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 C-N-CA 123.781 0.833 . . . . 0.0 111.361 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -77.6 -19.3 55.79 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -97.61 -7.45 31.09 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.977 -0.452 . . . . 0.0 110.724 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.655 ' SD ' ' HB ' ' A' ' 19' ' ' VAL . 87.7 mmm -51.15 -55.77 25.55 Favored Pre-proline 0 C--N 1.316 -0.854 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -55.49 -45.91 36.16 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.944 1.763 . . . . 0.0 111.129 178.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.63 -53.83 49.62 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 125.327 1.451 . . . . 0.0 110.055 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -66.79 -40.92 88.32 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.542 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 97.3 mmm -69.06 -28.05 66.19 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.836 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -72.59 -30.03 64.02 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.724 0.774 . . . . 0.0 108.925 178.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.9 -47.08 79.06 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.235 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -66.91 -33.33 75.35 Favored 'General case' 0 C--O 1.191 -1.976 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.044 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -59.62 -51.54 69.38 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -176.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.17 -47.83 82.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.095 177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 tp . . . . . 0 CA--C 1.552 1.027 0 C-N-CA 123.449 0.699 . . . . 0.0 111.64 -179.274 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.76 124.22 11.66 Favored 'Trans proline' 0 N--CA 1.438 -1.754 0 C-N-CA 121.367 1.378 . . . . 0.0 111.335 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 19' ' ' VAL . 43.7 t -74.76 112.83 11.36 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.93 178.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.45 -30.17 60.02 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 124.097 0.959 . . . . 0.0 111.664 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -78.71 -9.67 59.49 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.4 p -143.53 -22.89 0.6 Allowed 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.84 7.61 83.78 Favored Glycine 0 C--N 1.305 -1.144 0 C-N-CA 121.601 -0.333 . . . . 0.0 113.117 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -89.21 144.6 25.99 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.07 106.3 13.86 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.443 ' CG2' ' HB2' ' A' ' 12' ' ' CYS . 46.8 t -92.12 133.67 29.85 Favored Pre-proline 0 C--N 1.279 -2.483 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.742 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.95 126.87 18.16 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 122.144 1.896 . . . . 0.0 109.327 174.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.1 p -47.01 -40.0 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.591 0 C-N-CA 124.488 1.115 . . . . 0.0 113.457 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.4 p90 -66.77 -28.59 68.52 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -106.22 4.78 29.24 Favored 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 121.557 -0.714 . . . . 0.0 111.166 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -53.11 58.91 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.5 -41.58 39.42 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 121.651 1.567 . . . . 0.0 111.127 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -58.19 -48.94 78.77 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.67 1.188 . . . . 0.0 110.618 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -65.28 -42.4 93.2 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.588 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.21 -35.53 80.61 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.001 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -66.48 -34.73 78.59 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 123.764 0.665 . . . . 0.0 110.471 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -63.07 -42.77 99.75 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -63.55 -39.75 95.22 Favored 'General case' 0 C--O 1.194 -1.859 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.534 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.24 -50.91 72.18 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 120.411 0.148 . . . . 0.0 111.31 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.14 95.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.255 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp . . . . . 0 N--CA 1.465 0.297 0 C-N-CA 124.013 0.925 . . . . 0.0 111.074 -179.568 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.439 -0.993 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.27 124.95 11.36 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 121.091 1.194 . . . . 0.0 110.885 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.2 t -74.86 111.9 10.54 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.222 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -50.01 -33.27 17.51 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.435 1.094 . . . . 0.0 112.572 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -79.35 -9.4 59.58 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.9 p -142.95 -20.99 0.64 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.46 0.33 86.55 Favored Glycine 0 C--O 1.217 -0.934 0 C-N-CA 121.707 -0.282 . . . . 0.0 112.399 -177.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -82.74 139.43 33.62 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.53 106.79 10.72 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 54.3 t -100.81 132.47 22.12 Favored Pre-proline 0 C--N 1.293 -1.873 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.818 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.7 133.75 60.0 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.003 2.468 . . . . 0.0 110.772 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.0 p -52.97 -35.42 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.139 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.0 p90 -74.57 -23.53 58.77 Favored 'General case' 0 CA--C 1.55 0.981 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -105.51 3.23 29.2 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.263 -0.898 . . . . 0.0 110.75 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.96 -54.64 35.17 Favored Pre-proline 0 CA--C 1.563 1.448 0 C-N-CA 123.713 0.805 . . . . 0.0 111.895 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.07 -43.02 32.14 Favored 'Trans proline' 0 C--N 1.385 2.484 0 C-N-CA 121.904 1.736 . . . . 0.0 111.698 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -54.96 -51.87 64.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.484 1.113 . . . . 0.0 110.693 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.9 t60 -66.23 -40.42 90.24 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.863 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.2 mmm -68.26 -29.08 67.79 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.859 177.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -72.18 -31.47 65.95 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -63.77 -48.72 75.82 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.416 176.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -64.41 -37.16 86.56 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.182 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -63.07 -55.21 27.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.55 -34.16 75.09 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 123.162 0.585 . . . . 0.0 111.01 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 tp . . . . . 0 C--N 1.321 -0.652 0 O-C-N 123.518 0.511 . . . . 0.0 110.368 -179.709 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG23 ' SD ' ' A' ' 24' ' ' MET . 13.5 m . . . . . 0 N--CA 1.437 -1.099 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -66.91 122.15 9.45 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 121.804 1.669 . . . . 0.0 111.42 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.2 t -74.27 115.06 13.35 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.154 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.56 -35.8 42.59 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.739 0.816 . . . . 0.0 112.381 -177.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -76.36 -9.31 58.55 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -173.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.1 p -143.42 -25.7 0.58 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.5 -1.04 75.32 Favored Glycine 0 C--N 1.312 -0.764 0 C-N-CA 121.592 -0.337 . . . . 0.0 113.125 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -80.45 137.91 36.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.279 0.54 . . . . 0.0 109.746 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.33 103.79 6.52 Favored 'General case' 0 CA--C 1.498 -1.039 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.9 t -98.45 134.94 21.38 Favored Pre-proline 0 C--N 1.281 -2.37 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.932 -176.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.09 128.56 27.51 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.612 2.208 . . . . 0.0 109.767 174.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -50.64 -37.95 16.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 124.888 1.275 . . . . 0.0 112.53 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -69.97 -30.37 67.7 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -91.8 -0.12 57.51 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.826 -0.546 . . . . 0.0 111.185 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.425 ' SD ' HG23 ' A' ' 10' ' ' VAL 0.256 0.0 OUTLIER -51.47 -58.48 10.63 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.334 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.01 -45.22 37.55 Favored 'Trans proline' 0 C--N 1.369 1.637 0 C-N-CA 121.948 1.765 . . . . 0.0 111.157 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -54.03 -53.27 55.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.326 1.05 . . . . 0.0 110.858 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -65.99 -38.9 89.7 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 124.182 0.993 . . . . 0.0 110.872 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.5 mtp -68.03 -29.67 68.71 Favored 'General case' 0 C--O 1.203 -1.359 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.402 176.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.15 -32.16 70.01 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -62.99 -45.87 90.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.106 174.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -65.58 -35.6 81.29 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.874 -0.73 . . . . 0.0 109.957 176.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -60.06 -56.35 22.7 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -176.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.17 90.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.995 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 tp . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 -179.395 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.923 0 CA-C-O 120.918 0.39 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.15 52.87 2.43 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.486 0.66 . . . . 0.0 111.229 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -101.1 18.01 20.9 Favored 'General case' 0 CA--C 1.48 -1.732 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.199 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -93.7 109.69 21.34 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.6 m -102.36 144.9 29.53 Favored Pre-proline 0 C--N 1.282 -2.359 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.04 125.65 13.37 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 121.19 1.26 . . . . 0.0 112.147 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -74.4 111.59 9.74 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.728 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.15 -23.23 33.42 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 124.085 0.954 . . . . 0.0 113.168 -175.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -82.39 -18.18 42.89 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.3 p -135.07 -27.88 1.21 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.53 -5.24 64.62 Favored Glycine 0 C--N 1.308 -0.973 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.274 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.1 m -76.79 138.12 39.68 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.0 mt -79.04 106.08 10.82 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -108.52 131.4 21.79 Favored Pre-proline 0 C--N 1.288 -2.066 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.636 -174.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.13 127.99 25.55 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.838 2.359 . . . . 0.0 111.212 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.4 p -48.94 -38.53 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 125.464 1.505 . . . . 0.0 112.673 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 38.2 p90 -73.16 -17.17 61.41 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -98.31 -3.43 37.21 Favored 'General case' 0 CA--C 1.489 -1.4 0 O-C-N 122.302 -0.249 . . . . 0.0 110.587 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.42 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.4 mmt -52.41 -49.8 83.41 Favored Pre-proline 0 C--O 1.211 -0.96 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' MET . 9.4 Cg_endo -57.1 -49.07 15.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 121.546 1.497 . . . . 0.0 111.035 177.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -58.01 -50.33 73.77 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 124.616 1.167 . . . . 0.0 112.518 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -68.42 -41.99 79.58 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.292 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 89.5 mmm -66.36 -33.58 76.05 Favored 'General case' 0 CA--C 1.491 -1.298 0 O-C-N 121.883 -0.511 . . . . 0.0 110.847 177.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -67.69 -31.3 71.17 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.413 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -67.81 -40.26 83.86 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.728 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -66.47 -32.2 73.42 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.957 175.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -59.65 -57.96 10.67 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.99 -48.49 78.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.059 0.457 . . . . 0.0 111.234 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.4 tp -59.73 -46.57 88.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.184 -177.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 51.5 mt-10 -85.21 -11.34 55.16 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.79 -34.51 52.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 175.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -70.08 -4.01 19.17 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -178.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 65.4 pttt -105.06 -1.4 25.69 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.328 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -179.243 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.666 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 71.0 23.19 4.3 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.653 1.181 . . . . 0.0 111.13 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -94.11 16.04 15.63 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.44 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 93.8 mt-30 -108.91 107.64 18.1 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 169.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.402 HG23 ' HE2' ' A' ' 24' ' ' MET . 29.1 m -98.86 142.24 24.27 Favored Pre-proline 0 C--N 1.279 -2.496 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.8 130.39 21.77 Favored 'Trans proline' 0 N--CA 1.435 -1.951 0 C-N-CA 121.403 1.402 . . . . 0.0 111.287 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.5 t -73.5 123.17 23.39 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.669 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 35.4 mp0 -56.52 -35.86 68.53 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 123.848 0.859 . . . . 0.0 110.879 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -83.19 -9.31 59.24 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -142.75 -23.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.41 -1.52 76.42 Favored Glycine 0 C--N 1.312 -0.783 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.37 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.5 m -81.03 138.42 36.01 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -76.45 109.91 10.56 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.2 t -112.47 127.89 26.26 Favored Pre-proline 0 C--N 1.294 -1.839 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.0 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 76.0 Cg_exo -50.3 133.6 36.65 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.318 2.678 . . . . 0.0 111.676 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.2 p -48.96 -35.87 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 124.756 1.223 . . . . 0.0 112.985 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -79.52 -12.35 59.87 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -103.59 -4.8 23.39 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 121.742 -0.598 . . . . 0.0 110.564 177.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 10' ' ' VAL . 4.4 mmt -50.1 -55.53 23.99 Favored Pre-proline 0 N--CA 1.467 0.399 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.78 -47.36 27.63 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.857 1.705 . . . . 0.0 111.247 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.15 -51.78 67.95 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 124.381 1.072 . . . . 0.0 112.259 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -67.19 -43.51 81.96 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.771 -178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.5 mmm -68.17 -28.13 67.02 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 121.897 -0.502 . . . . 0.0 111.149 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -67.79 -37.93 82.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -62.02 -47.41 84.88 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.56 178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -63.68 -39.26 93.89 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.854 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -56.47 -56.74 17.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 123.896 0.748 . . . . 0.0 109.683 -175.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -66.89 -38.73 86.83 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.447 -178.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -64.69 -44.77 89.24 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.255 0.55 . . . . 0.0 111.118 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -82.34 -22.02 35.74 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.897 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.36 -30.07 69.77 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.087 0.47 . . . . 0.0 109.931 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -59.87 -38.57 82.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.367 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -99.6 -1.14 38.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.076 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.434 -1.264 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.496 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.316 0 CA-C-O 121.155 0.503 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.51 24.22 6.72 Favored 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -94.27 16.92 13.75 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.257 0.551 . . . . 0.0 111.532 -172.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -105.49 108.75 20.44 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 168.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.5 m -102.84 142.9 25.51 Favored Pre-proline 0 C--N 1.281 -2.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.0 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.19 122.77 9.32 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 121.748 1.632 . . . . 0.0 112.866 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 14.8 t -65.85 120.62 13.37 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 123.887 0.875 . . . . 0.0 109.699 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.85 -22.73 62.68 Favored 'General case' 0 C--N 1.301 -1.527 0 C-N-CA 123.397 0.679 . . . . 0.0 112.819 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -93.67 -9.32 38.27 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.8 -10.94 0.9 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.59 -5.19 75.31 Favored Glycine 0 C--N 1.312 -0.788 0 C-N-CA 121.017 -0.611 . . . . 0.0 113.178 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.1 m -79.83 138.81 37.31 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 122.487 0.315 . . . . 0.0 110.294 -178.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.5 mt -78.17 100.88 6.79 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.601 0.715 . . . . 0.0 109.195 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.3 t -104.67 133.34 20.23 Favored Pre-proline 0 C--N 1.282 -2.357 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.54 -174.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.19 128.33 28.68 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.367 2.045 . . . . 0.0 110.223 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.23 -35.21 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 C-N-CA 124.467 1.107 . . . . 0.0 112.627 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -75.27 -10.6 59.61 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -102.25 -9.1 20.72 Favored 'General case' 0 CA--C 1.503 -0.863 0 C-N-CA 122.829 0.451 . . . . 0.0 110.203 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.3 mmt -50.05 -55.14 26.4 Favored Pre-proline 0 N--CA 1.472 0.634 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -54.25 -50.04 14.91 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 121.998 1.799 . . . . 0.0 111.616 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -62.4 -46.42 88.69 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 124.226 1.01 . . . . 0.0 112.753 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -66.13 -46.4 77.65 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 123.084 0.554 . . . . 0.0 111.187 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 99.7 mmm -66.26 -29.5 69.75 Favored 'General case' 0 C--N 1.311 -1.08 0 O-C-N 121.878 -0.514 . . . . 0.0 110.528 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.39 -32.68 73.75 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.839 175.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -66.49 -45.58 79.15 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.674 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -66.36 -33.31 75.45 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.426 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.533 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 17.2 t80 -62.65 -58.43 7.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -176.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.58 -28.9 68.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.743 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.0 tp -68.08 -44.28 76.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.264 0.554 . . . . 0.0 110.601 179.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.663 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 43.5 mt-10 -98.34 -1.66 41.17 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.403 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 32' ' ' PHE . 21.1 tp -58.46 -22.72 55.6 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 123.343 0.657 . . . . 0.0 111.224 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.75 -19.08 61.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.13 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.663 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 18.1 ptpt -101.68 9.0 41.42 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.259 1.604 0 CA-C-O 118.646 -0.693 . . . . 0.0 109.998 -177.855 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 68.94 -37.98 0.38 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 171.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -94.02 16.1 15.34 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.225 0.536 . . . . 0.0 111.137 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -135.95 108.04 7.2 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -116.56 147.72 40.33 Favored Pre-proline 0 C--N 1.28 -2.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.792 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.54 124.63 12.67 Favored 'Trans proline' 0 N--CA 1.44 -1.664 0 C-N-CA 121.76 1.64 . . . . 0.0 111.316 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -70.84 117.41 12.31 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.43 -30.72 67.12 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -79.97 -8.89 59.58 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -142.33 -26.03 0.64 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.44 -9.33 69.29 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.945 -0.645 . . . . 0.0 113.045 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -74.88 138.93 42.78 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.06 103.37 7.95 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 49.3 t -108.0 133.61 20.43 Favored Pre-proline 0 C--N 1.294 -1.814 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.307 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.03 137.85 82.93 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.932 2.421 . . . . 0.0 112.112 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.5 p -50.73 -36.44 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 124.745 1.218 . . . . 0.0 112.399 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.8 p90 -71.23 -22.0 62.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.0 -11.31 36.37 Favored 'General case' 0 CA--C 1.491 -1.312 0 O-C-N 122.423 -0.173 . . . . 0.0 110.67 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.257 9.2 mmt -49.39 -56.34 16.88 Favored Pre-proline 0 C--O 1.219 -0.519 0 N-CA-C 116.254 1.946 . . . . 0.0 116.254 -174.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.67 -53.53 5.96 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.872 1.715 . . . . 0.0 111.511 179.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -55.37 -49.9 71.08 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.236 1.014 . . . . 0.0 112.186 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -66.9 -44.6 80.4 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.334 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 67.3 mtp -65.22 -36.18 83.37 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.766 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -70.96 -30.41 66.69 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.153 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 93.8 t80 -64.49 -40.44 95.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -63.86 -39.63 94.67 Favored 'General case' 0 C--O 1.202 -1.441 0 C-N-CA 120.276 -0.569 . . . . 0.0 110.151 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -56.7 -49.45 75.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 123.124 0.265 . . . . 0.0 111.605 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.24 -40.57 96.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.154 0.502 . . . . 0.0 110.286 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.17 -42.23 99.37 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.06 -18.05 51.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.695 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.4 tp -76.79 -43.75 35.52 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -69.26 -18.24 63.84 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.727 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.4 pttt 53.23 34.13 16.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.507 1.923 . . . . 0.0 112.289 177.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.3 p . . . . . 0 N--CA 1.414 -2.226 0 CA-C-N 114.618 -1.173 . . . . 0.0 109.458 179.912 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.029 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -108.34 6.67 26.65 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.126 0.489 . . . . 0.0 111.329 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -93.58 55.82 2.28 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-O 123.073 1.416 . . . . 0.0 108.359 176.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -122.91 111.59 16.82 Favored 'General case' 0 N--CA 1.421 -1.902 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 176.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.9 147.12 34.2 Favored Pre-proline 0 C--N 1.28 -2.445 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -176.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -70.74 131.83 20.61 Favored 'Trans proline' 0 N--CA 1.434 -2.009 0 C-N-CA 121.19 1.26 . . . . 0.0 111.493 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.3 t -74.03 116.42 14.63 Favored 'General case' 0 C--N 1.281 -2.401 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.304 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.34 -25.38 34.54 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -88.68 -9.91 50.38 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.9 p -142.57 -15.63 0.73 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.89 -1.87 86.98 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.704 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.1 m -82.27 134.33 35.28 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 122.522 -0.399 . . . . 0.0 110.318 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.4 mt -77.9 100.99 6.6 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.4 t -104.9 133.82 19.96 Favored Pre-proline 0 C--N 1.285 -2.206 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.174 -175.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -49.99 128.99 23.52 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 122.893 2.396 . . . . 0.0 111.13 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.9 p -48.52 -34.48 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.193 0 C-N-CA 124.948 1.299 . . . . 0.0 112.594 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 31.4 p90 -74.78 -16.93 60.7 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -98.74 -6.71 28.93 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 121.932 -0.48 . . . . 0.0 110.354 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.265 7.3 mmt -51.27 -57.55 13.69 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.97 -50.53 13.05 Favored 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.072 1.848 . . . . 0.0 111.325 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -54.57 -58.1 8.82 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.635 1.174 . . . . 0.0 113.177 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -63.28 -46.09 88.41 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.51 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.1 mmm -64.79 -36.35 84.05 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.257 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -69.61 -29.08 66.5 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.386 0.613 . . . . 0.0 110.122 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -63.55 -45.47 90.36 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.338 -0.846 . . . . 0.0 108.909 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -63.47 -41.69 98.6 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.191 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -54.51 -58.27 8.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 123.267 0.354 . . . . 0.0 111.633 -178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -67.45 -35.93 80.19 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.495 0.497 . . . . 0.0 111.604 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.4 tp -66.98 -49.65 64.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.481 0.658 . . . . 0.0 110.907 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -82.49 -13.56 56.48 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.749 -176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 62.0 tp -70.66 -12.84 61.81 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 174.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 70.4 mt-30 -82.64 -10.43 58.95 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.262 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -139.44 -34.08 0.59 Allowed 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.7 p . . . . . 0 N--CA 1.426 -1.632 0 CA-C-O 118.654 -0.688 . . . . 0.0 109.578 179.318 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.755 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.81 -32.35 73.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.755 0.788 . . . . 0.0 109.099 177.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -121.0 30.74 6.71 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.815 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -123.55 111.16 15.94 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 172.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.5 m -110.29 138.21 20.82 Favored Pre-proline 0 C--N 1.275 -2.657 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 -175.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.54 130.71 25.74 Favored 'Trans proline' 0 N--CA 1.435 -1.914 0 C-N-CA 121.578 1.519 . . . . 0.0 111.303 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 t -73.93 123.86 25.07 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.441 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.483 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 23.7 mp0 -58.83 -33.49 70.46 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.631 0.729 . . . . 0.0 110.616 -176.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -83.22 -9.26 59.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -174.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 p -142.04 -20.29 0.72 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.04 1.21 88.8 Favored Glycine 0 C--N 1.31 -0.894 0 C-N-CA 121.134 -0.555 . . . . 0.0 112.44 -178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.7 m -85.99 138.93 31.62 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 122.458 -0.437 . . . . 0.0 110.246 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.9 mt -75.56 110.5 10.0 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 122.943 0.497 . . . . 0.0 110.017 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 43.1 t -111.13 132.38 21.74 Favored Pre-proline 0 C--N 1.285 -2.212 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.277 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -54.57 130.89 42.53 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.736 2.291 . . . . 0.0 109.933 173.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 p -46.95 -37.89 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.16 0.984 . . . . 0.0 113.463 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.4 p90 -77.26 -12.64 59.97 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.48 -6.52 33.58 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 8.5 mmt -51.41 -55.72 26.68 Favored Pre-proline 0 C--O 1.211 -0.928 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -53.18 -49.46 17.43 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 121.694 1.596 . . . . 0.0 111.087 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -53.57 -58.31 7.64 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.973 1.309 . . . . 0.0 111.539 177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -65.81 -42.77 90.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.304 -175.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 93.9 mmm -70.12 -27.37 64.53 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.158 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.8 -36.68 75.86 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.89 -45.03 94.43 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.115 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -62.84 -41.08 99.2 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.695 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -57.79 -57.11 14.2 Favored 'General case' 0 N--CA 1.444 -0.731 0 O-C-N 123.578 0.549 . . . . 0.0 109.683 -174.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.18 93.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.173 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.19 -40.64 94.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 110.812 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HA ' ' OXT' ' A' ' 39' ' ' SER . 50.8 mt-10 -87.13 -8.44 56.98 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.44 0.638 . . . . 0.0 110.884 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.2 tp -86.13 -8.7 57.66 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.34 175.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.84 -37.4 84.41 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.524 0.678 . . . . 0.0 110.848 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -156.93 -50.11 0.07 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.471 ' OXT' ' HA ' ' A' ' 35' ' ' GLU . 54.3 m . . . . . 0 C--O 1.255 1.373 0 C-N-CA 128.647 2.779 . . . . 0.0 104.369 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.87 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 62.66 67.08 0.72 Allowed 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -170.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -93.51 12.63 24.47 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.123 -173.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -121.43 103.79 9.2 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 106.336 -1.728 . . . . 0.0 106.336 172.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.507 HG23 ' HE2' ' A' ' 24' ' ' MET . 18.5 m -116.99 134.78 22.95 Favored Pre-proline 0 C--N 1.276 -2.629 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.862 -174.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.98 129.38 20.59 Favored 'Trans proline' 0 N--CA 1.441 -1.604 0 C-N-CA 121.562 1.508 . . . . 0.0 110.642 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.3 t -72.83 114.91 11.49 Favored 'General case' 0 C--N 1.282 -2.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -52.04 -33.93 40.97 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 123.788 0.835 . . . . 0.0 111.461 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -80.99 -9.71 59.81 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -175.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.0 p -143.31 -21.17 0.62 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.34 -4.58 80.48 Favored Glycine 0 C--N 1.314 -0.688 0 C-N-CA 121.621 -0.323 . . . . 0.0 112.759 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -80.54 141.68 34.87 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.413 -0.463 . . . . 0.0 109.825 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.8 mt -77.42 114.34 16.15 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.465 0.65 . . . . 0.0 109.703 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.9 t -115.0 133.06 22.71 Favored Pre-proline 0 C--N 1.29 -1.983 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.084 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.12 136.77 76.98 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.258 1.972 . . . . 0.0 110.157 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.6 p -49.52 -34.53 8.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 C-N-CA 124.003 0.921 . . . . 0.0 112.098 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -79.92 -10.28 59.76 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -98.45 -13.18 20.69 Favored 'General case' 0 CA--C 1.494 -1.189 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.507 ' HE2' HG23 ' A' ' 10' ' ' VAL . 7.3 mmt -50.93 -54.02 41.57 Favored Pre-proline 0 C--O 1.212 -0.877 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.7 -49.37 16.98 Favored 'Trans proline' 0 C--N 1.363 1.293 0 C-N-CA 121.561 1.507 . . . . 0.0 111.428 176.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -54.14 -55.31 28.98 Favored 'General case' 0 C--O 1.25 1.127 0 C-N-CA 124.698 1.199 . . . . 0.0 111.453 177.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -68.75 -41.3 79.11 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.804 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 13.6 mmt -67.01 -34.82 78.58 Favored 'General case' 0 CA--C 1.485 -1.556 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.094 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -63.35 -34.44 77.72 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -62.05 -48.64 79.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.668 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.405 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 81.8 m-70 -64.29 -42.03 96.58 Favored 'General case' 0 C--O 1.193 -1.901 0 C-N-CA 119.901 -0.719 . . . . 0.0 110.464 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -57.44 -49.02 77.57 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 122.666 0.386 . . . . 0.0 111.358 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.459 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -65.24 -36.17 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.904 0.383 . . . . 0.0 110.326 177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 tp -65.87 -40.91 92.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.723 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 31' ' ' HIS . 50.2 mt-10 -77.9 -25.68 48.64 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 123.25 0.62 . . . . 0.0 109.699 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.585 ' HA ' ' OG ' ' A' ' 39' ' ' SER . 52.5 tp -79.09 0.86 26.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.693 0.759 . . . . 0.0 110.018 -177.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 25.9 mt-30 -87.78 -18.53 29.18 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.84 175.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -135.64 34.06 2.96 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.255 0.55 . . . . 0.0 110.558 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.585 ' OG ' ' HA ' ' A' ' 36' ' ' LEU . 55.5 m . . . . . 0 C--N 1.305 -1.365 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.27 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 66.69 46.51 1.74 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.462 1.105 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -93.27 39.16 1.05 Allowed 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.958 0.885 . . . . 0.0 109.58 -177.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -125.15 105.73 9.37 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m -107.07 146.54 33.38 Favored Pre-proline 0 C--N 1.275 -2.645 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.47 -173.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.09 130.28 18.67 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.704 1.603 . . . . 0.0 112.082 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.7 t -74.16 117.31 15.81 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.756 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -52.22 -33.84 42.98 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.079 0.552 . . . . 0.0 112.446 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -82.12 -8.91 59.67 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 p -141.92 -25.15 0.68 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.24 -6.3 75.46 Favored Glycine 0 C--O 1.22 -0.729 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.092 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.3 m -79.99 139.06 37.16 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.7 mt -76.8 114.79 15.96 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.425 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 53.1 t -121.41 135.19 24.84 Favored Pre-proline 0 C--N 1.3 -1.565 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.148 -177.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -53.17 130.14 36.77 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.889 2.392 . . . . 0.0 111.451 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.8 p -50.17 -34.93 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 124.19 0.996 . . . . 0.0 113.092 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -77.14 -17.89 58.28 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -100.74 -3.61 29.76 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.425 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -49.96 -57.92 11.05 Favored Pre-proline 0 N--CA 1.474 0.733 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -56.24 -43.18 58.56 Favored 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 121.89 1.727 . . . . 0.0 111.535 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -56.76 -55.68 31.11 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.882 1.273 . . . . 0.0 110.879 177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.15 -44.66 91.46 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.131 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.52 ' O ' ' HD1' ' A' ' 32' ' ' PHE . 8.1 mmt -61.76 -37.09 83.0 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.586 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.93 -33.16 75.19 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 123.583 0.552 . . . . 0.0 109.692 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -62.23 -45.24 94.23 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.822 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -62.15 -41.98 98.82 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.266 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.52 ' HD1' ' O ' ' A' ' 28' ' ' MET . 17.1 m-85 -59.45 -58.04 10.35 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.98 69.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.896 0.379 . . . . 0.0 111.261 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 tp -69.58 -45.64 68.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.368 0.604 . . . . 0.0 110.229 177.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 43.7 mt-10 -86.95 -3.94 59.13 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.887 0.851 . . . . 0.0 111.571 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 57.9 tp -75.43 -16.85 60.3 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -87.97 -23.66 23.79 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.271 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 63.6 pttt -80.3 -17.0 53.36 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.456 0.646 . . . . 0.0 111.139 -174.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.299 -1.61 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 178.715 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.775 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 67.02 26.38 9.04 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 124.094 0.871 . . . . 0.0 111.165 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -93.81 15.18 17.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 122.615 1.198 . . . . 0.0 108.638 175.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -127.11 103.27 7.35 Favored 'General case' 0 N--CA 1.423 -1.823 0 N-CA-C 103.692 -2.707 . . . . 0.0 103.692 169.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.3 141.47 22.6 Favored Pre-proline 0 C--N 1.281 -2.412 0 CA-C-O 120.677 0.275 . . . . 0.0 111.334 -173.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -68.22 124.79 12.12 Favored 'Trans proline' 0 N--CA 1.431 -2.178 0 C-N-CA 121.794 1.663 . . . . 0.0 111.954 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.8 t -71.71 117.35 13.18 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.267 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -57.47 -31.33 65.85 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 123.715 0.634 . . . . 0.0 110.76 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -81.94 -9.54 59.55 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 31.4 p -143.64 -21.18 0.59 Allowed 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 177.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.77 -2.36 76.5 Favored Glycine 0 C--N 1.313 -0.745 0 C-N-CA 121.496 -0.383 . . . . 0.0 113.384 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.82 140.43 34.19 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.3 mt -81.09 102.47 10.26 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 31.9 t -100.73 132.35 22.35 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.468 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.92 127.0 23.82 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.548 2.165 . . . . 0.0 110.734 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 p -50.64 -32.34 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 125.221 1.408 . . . . 0.0 113.031 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -74.12 -24.02 59.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 178.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -101.67 -0.48 34.54 Favored 'General case' 0 CA--C 1.492 -1.253 0 O-C-N 121.824 -0.547 . . . . 0.0 110.5 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 28' ' ' MET . 0.2 OUTLIER -51.77 -52.68 58.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 179.006 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -59.17 -44.84 31.2 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 121.53 1.486 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.45 -48.42 79.22 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 124.655 1.182 . . . . 0.0 111.316 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -65.46 -42.15 92.63 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.942 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 24' ' ' MET . 49.2 mtp -69.04 -29.82 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.768 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.13 -35.17 73.89 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -64.9 -45.88 84.04 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.833 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -65.16 -34.64 78.87 Favored 'General case' 0 C--O 1.2 -1.524 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.724 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -59.31 -56.14 25.88 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' A' ' 36' ' ' LEU . . . -64.58 -38.96 92.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.871 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.6 tp -63.92 -42.87 97.26 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-O 121.472 0.653 . . . . 0.0 110.922 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -83.68 -10.19 58.34 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.576 0.703 . . . . 0.0 110.401 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.5 tt -73.95 -31.26 62.94 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 172.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 90.0 mt-30 -80.12 -48.9 12.47 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 176.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt 51.2 33.73 10.06 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.652 1.581 . . . . 0.0 113.176 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.261 1.666 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.703 177.903 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.156 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 66.61 19.42 10.82 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.396 1.078 . . . . 0.0 111.681 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -122.0 20.28 10.76 Favored 'General case' 0 CA--C 1.488 -1.412 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.003 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -96.6 109.06 21.74 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 119.274 -0.97 . . . . 0.0 108.481 177.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.8 m -102.53 144.13 27.98 Favored Pre-proline 0 C--N 1.284 -2.245 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.09 125.06 11.56 Favored 'Trans proline' 0 N--CA 1.439 -1.706 0 C-N-CA 121.628 1.552 . . . . 0.0 111.983 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.9 t -72.55 117.55 14.36 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.918 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -55.24 -27.6 47.4 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 124.417 1.087 . . . . 0.0 113.22 -175.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 61.7 mttm -86.1 -9.56 56.47 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 29.9 p -140.83 -27.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 116.209 1.929 . . . . 0.0 116.209 -177.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.22 -7.29 75.83 Favored Glycine 0 C--N 1.308 -1.012 0 C-N-CA 121.273 -0.489 . . . . 0.0 111.945 -178.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 m -77.41 138.0 39.03 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.19 111.73 13.12 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.404 ' HB ' ' CE ' ' A' ' 24' ' ' MET . 24.8 t -113.07 130.54 23.47 Favored Pre-proline 0 C--N 1.283 -2.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.869 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.64 128.88 31.25 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.487 2.125 . . . . 0.0 110.526 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.7 p -48.55 -34.35 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.403 0 C-N-CA 125.479 1.512 . . . . 0.0 112.676 -175.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.8 p90 -77.61 -15.38 59.25 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -100.12 -4.15 30.32 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.404 ' CE ' ' HB ' ' A' ' 19' ' ' VAL . 7.4 mmt -51.05 -58.27 10.97 Favored Pre-proline 0 C--O 1.208 -1.131 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.2 -46.17 35.83 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.124 1.883 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.93 -51.7 68.94 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 125.116 1.367 . . . . 0.0 112.152 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -64.55 -33.93 77.05 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.548 0.689 . . . . 0.0 109.804 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.427 ' HA ' ' CE ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -64.61 -36.46 84.32 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.413 175.135 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.8 -34.7 78.4 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.584 0.552 . . . . 0.0 109.882 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.52 -50.58 70.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.607 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -65.18 -36.69 84.99 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.307 178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -56.48 -56.87 15.87 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -62.2 -46.46 88.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.735 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.8 tp -61.72 -42.76 99.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.591 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.434 ' OE2' ' HD3' ' A' ' 14' ' ' LYS . 47.0 mt-10 -82.4 -18.76 40.79 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.087 0.47 . . . . 0.0 110.803 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.0 tp -76.53 -22.65 54.1 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 28.0 mm-40 -63.28 -43.62 97.41 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.372 0.606 . . . . 0.0 109.739 178.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -90.77 23.25 3.18 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.403 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 C--O 1.256 1.414 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.653 179.099 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.878 0 CA-C-O 120.891 0.377 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -94.16 12.75 25.48 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 121.31 0.576 . . . . 0.0 110.896 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -93.4 56.69 2.49 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -132.71 115.84 15.86 Favored 'General case' 0 N--CA 1.422 -1.841 0 CA-C-N 113.231 -1.804 . . . . 0.0 106.329 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -103.19 143.04 25.81 Favored Pre-proline 0 C--N 1.283 -2.311 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.07 124.82 12.69 Favored 'Trans proline' 0 N--CA 1.436 -1.87 0 C-N-CA 121.084 1.189 . . . . 0.0 110.158 177.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.4 t -74.19 110.67 8.67 Favored 'General case' 0 C--N 1.275 -2.652 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.169 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -46.88 -34.03 5.06 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -80.9 -8.99 59.87 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.7 p -142.67 -23.22 0.65 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 178.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.88 -7.74 76.67 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.074 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.3 m -78.89 138.69 38.24 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.52 103.85 7.7 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.8 t -106.1 129.02 25.23 Favored Pre-proline 0 C--N 1.283 -2.312 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.353 -175.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.45 130.88 26.54 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.97 2.447 . . . . 0.0 111.291 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 10.0 p -51.96 -37.64 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.624 -175.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.8 p90 -75.85 -13.24 60.27 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -101.11 -1.12 34.87 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . 0.256 8.6 mmt -52.53 -52.57 62.43 Favored Pre-proline 0 C--O 1.216 -0.701 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -50.85 -53.12 7.69 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.875 1.717 . . . . 0.0 111.161 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.28 -55.85 24.22 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 124.915 1.286 . . . . 0.0 112.077 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -67.54 -41.87 83.59 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.745 -176.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 95.3 mmm -69.59 -29.27 66.76 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.665 -0.647 . . . . 0.0 111.276 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -69.89 -29.87 67.17 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -64.9 -47.12 78.95 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.416 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 83.4 m-70 -65.37 -38.87 91.36 Favored 'General case' 0 C--O 1.195 -1.764 0 C-N-CA 119.59 -0.844 . . . . 0.0 110.718 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -58.72 -53.29 59.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.722 0.237 . . . . 0.0 111.601 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -61.62 -40.95 96.66 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.968 178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 35.1 tp -63.12 -42.14 99.47 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.456 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.421 ' HA ' ' HE3' ' A' ' 38' ' ' LYS . 46.4 mt-10 -72.42 -28.85 63.23 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.52 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.8 tp -77.28 -25.76 51.7 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 121.478 0.656 . . . . 0.0 109.532 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.1 mm100 -82.44 -32.41 29.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.684 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -100.06 -22.89 15.04 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -177.019 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 C--N 1.311 -1.102 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.738 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 121.848 0.832 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -104.2 18.94 21.08 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.293 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -94.53 10.82 33.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.934 0.873 . . . . 0.0 109.695 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -131.52 118.58 20.35 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 170.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.6 m -119.34 143.8 35.13 Favored Pre-proline 0 C--N 1.28 -2.423 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.97 130.62 16.93 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 120.973 1.116 . . . . 0.0 110.21 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.3 t -72.55 110.99 7.32 Favored 'General case' 0 C--N 1.286 -2.183 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 176.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -54.75 -22.73 15.02 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -81.51 -26.41 35.15 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.1 p -128.63 -19.14 3.79 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.94 -3.18 85.94 Favored Glycine 0 C--N 1.306 -1.101 0 C-N-CA 121.347 -0.454 . . . . 0.0 112.951 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -79.71 144.68 33.46 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.61 115.01 21.39 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.355 0.598 . . . . 0.0 109.948 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.655 ' HB ' ' SD ' ' A' ' 24' ' ' MET . 28.4 t -113.49 136.19 21.92 Favored Pre-proline 0 C--N 1.291 -1.95 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.482 -177.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -59.26 141.07 97.36 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.021 1.814 . . . . 0.0 110.61 176.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.5 p -53.83 -34.44 25.26 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 C-N-CA 123.781 0.833 . . . . 0.0 111.361 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.4 p90 -77.6 -19.3 55.79 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -97.61 -7.45 31.09 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.977 -0.452 . . . . 0.0 110.724 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.655 ' SD ' ' HB ' ' A' ' 19' ' ' VAL . 87.7 mmm -51.15 -55.77 25.55 Favored Pre-proline 0 C--N 1.316 -0.854 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -55.49 -45.91 36.16 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 121.944 1.763 . . . . 0.0 111.129 178.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.63 -53.83 49.62 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 125.327 1.451 . . . . 0.0 110.055 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -66.79 -40.92 88.32 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.542 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 97.3 mmm -69.06 -28.05 66.19 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.836 178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -72.59 -30.03 64.02 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 121.724 0.774 . . . . 0.0 108.925 178.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.9 -47.08 79.06 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.235 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.468 ' HB3' ' OE2' ' A' ' 35' ' ' GLU . 87.6 m-70 -66.91 -33.33 75.35 Favored 'General case' 0 C--O 1.191 -1.976 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.044 177.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -59.62 -51.54 69.38 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -176.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -62.17 -47.83 82.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.095 177.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.46 -36.93 74.45 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.449 0.699 . . . . 0.0 111.64 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' OE2' ' HB3' ' A' ' 31' ' ' HIS . 43.1 mt-10 -83.85 -21.15 32.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 123.439 0.696 . . . . 0.0 111.8 178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -76.45 -33.13 58.75 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.125 -1.806 . . . . 0.0 106.125 175.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 17.1 mm-40 -80.78 -7.24 59.34 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.414 174.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 pttp 62.54 -21.11 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 129.148 2.979 . . . . 0.0 115.414 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 CA--C 1.545 0.781 0 C-N-CA 124.08 0.952 . . . . 0.0 109.329 -174.91 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.468 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . . . . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -86.4 -50.93 6.54 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -175.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -116.15 17.3 15.8 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.211 0.529 . . . . 0.0 110.923 -176.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 6' ' ' ALA . 50.9 mt-30 -121.76 117.91 27.76 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 176.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -120.91 129.29 25.37 Favored Pre-proline 0 C--N 1.292 -1.897 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.135 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.76 124.22 11.66 Favored 'Trans proline' 0 N--CA 1.438 -1.754 0 C-N-CA 121.367 1.378 . . . . 0.0 111.335 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 19' ' ' VAL . 43.7 t -74.76 112.83 11.36 Favored 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.93 178.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -55.45 -30.17 60.02 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 124.097 0.959 . . . . 0.0 111.664 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -78.71 -9.67 59.49 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.4 p -143.53 -22.89 0.6 Allowed 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.84 7.61 83.78 Favored Glycine 0 C--N 1.305 -1.144 0 C-N-CA 121.601 -0.333 . . . . 0.0 113.117 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -89.21 144.6 25.99 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.07 106.3 13.86 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.443 ' CG2' ' HB2' ' A' ' 12' ' ' CYS . 46.8 t -92.12 133.67 29.85 Favored Pre-proline 0 C--N 1.279 -2.483 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.742 -176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.95 126.87 18.16 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 C-N-CA 122.144 1.896 . . . . 0.0 109.327 174.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.1 p -47.01 -40.0 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.591 0 C-N-CA 124.488 1.115 . . . . 0.0 113.457 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.4 p90 -66.77 -28.59 68.52 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -106.22 4.78 29.24 Favored 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 121.557 -0.714 . . . . 0.0 111.166 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -53.11 58.91 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.5 -41.58 39.42 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 121.651 1.567 . . . . 0.0 111.127 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -58.19 -48.94 78.77 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.67 1.188 . . . . 0.0 110.618 176.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -65.28 -42.4 93.2 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.588 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 85.0 mmm -63.21 -35.53 80.61 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.001 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -66.48 -34.73 78.59 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 123.764 0.665 . . . . 0.0 110.471 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -63.07 -42.77 99.75 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -63.55 -39.75 95.22 Favored 'General case' 0 C--O 1.194 -1.859 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.534 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.24 -50.91 72.18 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 120.411 0.148 . . . . 0.0 111.31 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 37' ' ' GLN . . . -64.57 -42.14 95.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.255 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.9 tp -62.53 -42.4 99.5 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.013 0.925 . . . . 0.0 111.074 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 52.2 mt-10 -75.4 -20.87 58.67 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.338 178.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.6 tp -83.95 -12.37 55.45 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 28.8 mm-40 -74.75 -2.19 25.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 24.3 pttm -84.77 -9.47 58.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.417 0.627 . . . . 0.0 110.216 176.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.428 -1.525 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 179.781 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.94 52.27 2.42 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.751 0.786 . . . . 0.0 109.428 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -137.96 72.42 1.41 Allowed 'General case' 0 C--O 1.248 0.977 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.767 -175.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.481 ' HG2' ' HA ' ' A' ' 20' ' ' PRO . 68.1 mt-30 -128.38 156.68 42.74 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.9 m -135.06 138.95 30.56 Favored Pre-proline 0 C--N 1.296 -1.744 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.27 124.95 11.36 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 121.091 1.194 . . . . 0.0 110.885 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.2 t -74.86 111.9 10.54 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.222 178.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -50.01 -33.27 17.51 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.435 1.094 . . . . 0.0 112.572 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -79.35 -9.4 59.58 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.9 p -142.95 -20.99 0.64 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.46 0.33 86.55 Favored Glycine 0 C--O 1.217 -0.934 0 C-N-CA 121.707 -0.282 . . . . 0.0 112.399 -177.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.3 m -82.74 139.43 33.62 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.53 106.79 10.72 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 54.3 t -100.81 132.47 22.12 Favored Pre-proline 0 C--N 1.293 -1.873 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.818 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.481 ' HA ' ' HG2' ' A' ' 9' ' ' GLN . 45.4 Cg_exo -56.7 133.75 60.0 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.003 2.468 . . . . 0.0 110.772 175.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.0 p -52.97 -35.42 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.139 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.0 p90 -74.57 -23.53 58.77 Favored 'General case' 0 CA--C 1.55 0.981 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -105.51 3.23 29.2 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.263 -0.898 . . . . 0.0 110.75 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.96 -54.64 35.17 Favored Pre-proline 0 CA--C 1.563 1.448 0 C-N-CA 123.713 0.805 . . . . 0.0 111.895 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.07 -43.02 32.14 Favored 'Trans proline' 0 C--N 1.385 2.484 0 C-N-CA 121.904 1.736 . . . . 0.0 111.698 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -54.96 -51.87 64.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.484 1.113 . . . . 0.0 110.693 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.9 t60 -66.23 -40.42 90.24 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.863 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.2 mmm -68.26 -29.08 67.79 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.859 177.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -72.18 -31.47 65.95 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -63.77 -48.72 75.82 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.416 176.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -64.41 -37.16 86.56 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.182 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -63.07 -55.21 27.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -174.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.501 ' O ' ' HG3' ' A' ' 37' ' ' GLN . . . -61.55 -34.16 75.09 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 123.162 0.585 . . . . 0.0 111.01 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 tp -68.03 -42.9 79.93 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.518 0.511 . . . . 0.0 110.368 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -86.11 -16.75 37.02 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.259 0.552 . . . . 0.0 110.777 -176.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.2 tp -82.18 -5.83 58.76 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.812 0.815 . . . . 0.0 109.397 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 33' ' ' ALA . 98.2 mt-30 -73.7 -16.43 61.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.293 62.0 pttt 53.42 2.54 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 127.835 2.454 . . . . 0.0 116.905 175.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.415 -2.22 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.052 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' C ' ' H ' ' A' ' 8' ' ' ASP . . . . . . . . 0 CA--C 1.504 -0.79 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.08 33.77 0.13 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.469 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.507 ' H ' ' C ' ' A' ' 6' ' ' ALA . 2.4 m-20 -98.42 63.25 1.5 Allowed 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 104.061 -2.57 . . . . 0.0 104.061 -178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.22 144.9 51.16 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.533 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG23 ' SD ' ' A' ' 24' ' ' MET . 13.5 m -133.16 136.43 27.41 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -66.91 122.15 9.45 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 121.804 1.669 . . . . 0.0 111.42 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.2 t -74.27 115.06 13.35 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.154 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -51.56 -35.8 42.59 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.739 0.816 . . . . 0.0 112.381 -177.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -76.36 -9.31 58.55 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -173.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 28.1 p -143.42 -25.7 0.58 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.5 -1.04 75.32 Favored Glycine 0 C--N 1.312 -0.764 0 C-N-CA 121.592 -0.337 . . . . 0.0 113.125 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -80.45 137.91 36.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.279 0.54 . . . . 0.0 109.746 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.33 103.79 6.52 Favored 'General case' 0 CA--C 1.498 -1.039 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.9 t -98.45 134.94 21.38 Favored Pre-proline 0 C--N 1.281 -2.37 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.932 -176.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.09 128.56 27.51 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.612 2.208 . . . . 0.0 109.767 174.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -50.64 -37.95 16.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 C-N-CA 124.888 1.275 . . . . 0.0 112.53 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -69.97 -30.37 67.7 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -91.8 -0.12 57.51 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.826 -0.546 . . . . 0.0 111.185 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.425 ' SD ' HG23 ' A' ' 10' ' ' VAL 0.256 0.0 OUTLIER -51.47 -58.48 10.63 Favored Pre-proline 0 C--N 1.321 -0.657 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -179.334 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.01 -45.22 37.55 Favored 'Trans proline' 0 C--N 1.369 1.637 0 C-N-CA 121.948 1.765 . . . . 0.0 111.157 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -54.03 -53.27 55.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.326 1.05 . . . . 0.0 110.858 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -65.99 -38.9 89.7 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 124.182 0.993 . . . . 0.0 110.872 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 83.5 mtp -68.03 -29.67 68.71 Favored 'General case' 0 C--O 1.203 -1.359 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.402 176.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.15 -32.16 70.01 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -62.99 -45.87 90.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.106 174.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -65.58 -35.6 81.29 Favored 'General case' 0 C--O 1.203 -1.342 0 C-N-CA 119.874 -0.73 . . . . 0.0 109.957 176.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -60.06 -56.35 22.7 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -176.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.17 90.25 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.995 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 tp -65.53 -41.05 93.51 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.992 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.14 -17.05 51.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.166 0.507 . . . . 0.0 109.921 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 55.7 tp -87.21 -12.46 46.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.756 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -55.85 -52.03 65.46 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -107.13 -3.48 19.87 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.247 0.939 0 C-N-CA 125.05 1.34 . . . . 0.0 110.641 179.904 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 336' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_