data_6ux5_residue ############################ # Computer software used # ############################ 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 6ux5 _Structure_validation_residue.Date_analyzed 2020-11-20 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 ' 5' ' ' ASP . . . . . 0.408 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 13.3 t70 . . . . . 0 N--CA 1.427 -1.62 0 N-CA-C 107.192 -1.411 . . . . 0.0 107.192 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.11 -31.27 0.02 OUTLIER Glycine 0 C--N 1.343 0.921 0 N-CA-C 107.366 -2.294 . . . . 0.0 107.366 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.75 -33.74 10.46 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.65 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.66 82.19 Favored 'General case' 0 N--CA 1.428 -1.54 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.52 -25.91 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.53 -24.66 67.9 Favored 'General case' 0 CA--C 1.504 -0.821 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.14 -42.31 56.49 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -57.4 -45.06 84.94 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -70.86 -39.31 72.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.1 t70 -59.17 -52.06 67.31 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.9 m -70.94 -26.9 63.38 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.459 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.02 -48.37 80.57 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.3 p -62.44 -38.76 91.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.4 mptt -65.14 -31.14 72.18 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.1 t80 -74.3 -49.23 23.86 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.459 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.92 76.41 Favored 'General case' 0 CA--C 1.487 -1.448 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.6 t -62.77 -34.51 77.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.3 t . . . . . 0 C--N 1.348 0.522 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.5 -0.962 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.6 m -62.05 -40.67 96.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.92 -30.42 63.89 Favored 'General case' 0 C--N 1.349 0.578 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.448 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.2 t60 -65.54 -36.48 83.93 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.86 -36.41 76.8 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 82.5 m -62.42 -40.0 95.12 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -71.38 -38.95 71.5 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.448 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.4 t -65.37 -37.57 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 44' ' ' CYS . 4.4 mttm -64.65 -37.5 87.79 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.3 t-80 -64.48 -42.04 96.13 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -60.55 -46.48 90.02 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -71.07 -33.69 70.47 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.421 ' N ' ' O ' ' A' ' 40' ' ' LYS . 35.3 t -66.92 -38.5 86.32 Favored 'General case' 0 CA--C 1.48 -1.729 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.88 -39.46 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -62.92 -32.23 73.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.0 m -91.71 -46.94 7.64 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.916 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.92 -40.4 63.28 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.65 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.06 11.48 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -177.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 C--O 1.262 1.713 0 C-N-CA 122.616 2.211 . . . . 0.0 112.393 179.48 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.41 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.2 t70 . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.67 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.36 -34.45 9.96 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.653 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.3 -36.32 81.76 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.592 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -70.49 -24.84 25.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -179.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.78 -24.35 67.73 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.37 -42.07 54.88 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.32 -44.85 84.54 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -71.05 -39.16 72.43 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.2 t70 -59.0 -52.31 66.3 Favored 'General case' 0 C--O 1.219 -0.515 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.1 m -70.97 -27.0 63.41 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.479 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.1 t80 -61.98 -48.6 79.61 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.78 -37.91 88.51 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.53 -31.15 72.06 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.659 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.32 -48.65 26.94 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.479 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.27 -37.08 74.27 Favored 'General case' 0 CA--C 1.488 -1.423 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -63.22 -34.54 77.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t . . . . . 0 CA--C 1.51 -0.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.7 m -63.14 -41.66 99.34 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.6 m -67.36 -36.03 80.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.444 ' CD2' HG22 ' A' ' 39' ' ' VAL . 79.3 t60 -63.47 -36.18 82.89 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -59.62 -36.75 76.93 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.3 m -62.23 -39.98 94.63 Favored 'General case' 0 CA--C 1.496 -1.11 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -71.44 -38.62 71.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.444 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -65.07 -37.52 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.989 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -64.76 -37.32 87.21 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.6 t-80 -64.23 -41.89 96.81 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.8 m -60.24 -46.33 90.16 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.98 -33.93 70.9 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.93 -37.9 85.18 Favored 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.29 -39.3 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -62.5 -32.36 73.27 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -94.07 -44.68 7.91 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.896 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.27 63.5 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.653 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.48 69.85 9.61 Favored Pre-proline 0 C--N 1.349 0.581 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 -177.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.677 2.252 . . . . 0.0 112.444 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.7 t70 . . . . . 0 N--CA 1.432 -1.373 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.66 -31.56 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 N-CA-C 107.305 -2.318 . . . . 0.0 107.305 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.0 m -100.39 -34.24 10.04 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.36 -36.21 81.52 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.63 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.587 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.69 -24.82 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.548 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.52 -24.66 67.91 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.06 55.82 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.24 -44.85 84.22 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -71.04 -39.11 72.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.411 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 29.3 t70 -58.96 -52.48 65.57 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.7 m -70.94 -26.89 63.38 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.466 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.03 -48.54 79.79 Favored 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.2 p -62.94 -38.08 89.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.68 -30.25 70.91 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -75.16 -49.09 20.62 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.29 -37.99 76.11 Favored 'General case' 0 CA--C 1.49 -1.356 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.9 t -63.66 -35.32 80.16 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 16.6 t . . . . . 0 C--N 1.348 0.514 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 -179.7 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.503 -0.827 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.1 m -62.23 -41.25 98.23 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -30.87 68.28 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.427 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.2 t60 -66.07 -37.14 85.08 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -60.29 -37.15 79.59 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.5 m -62.9 -39.89 95.89 Favored 'General case' 0 CA--C 1.497 -1.068 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -71.03 -38.79 72.58 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.427 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.3 t -65.18 -37.92 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -65.11 -37.16 86.57 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.4 t-80 -64.03 -41.66 97.34 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.6 m -60.16 -46.56 89.27 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.29 -33.68 69.95 Favored 'General case' 0 C--N 1.344 0.349 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.0 t -66.8 -37.88 85.41 Favored 'General case' 0 CA--C 1.482 -1.653 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.5 -39.32 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.799 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -62.64 -32.29 73.3 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.0 m -94.02 -44.61 7.97 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 119.643 -0.823 . . . . 0.0 108.923 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.34 62.97 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -178.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.59 69.97 9.55 Favored Pre-proline 0 C--N 1.349 0.571 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -177.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.262 1.692 0 C-N-CA 122.646 2.231 . . . . 0.0 112.393 179.672 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 . . . . . 0 N--CA 1.427 -1.583 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.48 -30.4 0.02 OUTLIER Glycine 0 C--N 1.341 0.844 0 N-CA-C 107.309 -2.317 . . . . 0.0 107.309 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.4 m -99.74 -33.35 10.62 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.653 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.591 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -69.94 -25.23 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -24.17 67.61 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.44 -41.64 55.35 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -57.35 -44.89 84.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -71.22 -38.95 71.98 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.421 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 21.8 t70 -58.97 -52.41 65.87 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.1 m -70.84 -26.78 63.43 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.463 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.06 -48.44 80.24 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.72 -38.7 91.51 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.483 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -64.85 -31.16 72.26 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.658 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.4 t80 -74.03 -49.67 23.19 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.8 mmmt -58.29 -37.83 75.81 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.3 t -63.37 -34.85 78.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.1 t . . . . . 0 CA--C 1.512 -0.494 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.701 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.501 -0.924 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -61.97 -41.29 97.85 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -31.22 68.5 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.425 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.5 t60 -65.78 -37.4 86.2 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -60.21 -36.99 78.91 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 82.6 m -62.84 -39.97 96.01 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -71.2 -38.67 72.07 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.425 HG23 ' CD2' ' A' ' 35' ' ' HIS . 56.0 t -65.32 -38.04 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.5 mtpt -64.81 -37.37 87.4 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.658 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.6 t-80 -63.85 -42.14 97.64 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.8 m -60.18 -46.14 90.71 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.03 -33.73 70.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.1 t -66.94 -37.94 85.24 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.33 -39.22 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.828 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -62.53 -32.51 73.46 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -94.25 -44.4 7.98 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 119.549 -0.86 . . . . 0.0 108.885 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -40.16 62.76 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.653 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.62 69.74 9.48 Favored Pre-proline 0 C--N 1.35 0.593 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 -177.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.652 2.234 . . . . 0.0 112.398 179.646 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 16.4 t70 . . . . . 0 N--CA 1.433 -1.31 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.68 -31.6 0.02 OUTLIER Glycine 0 CA--C 1.501 -0.819 0 N-CA-C 107.38 -2.288 . . . . 0.0 107.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.0 m -100.58 -34.33 9.94 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.647 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.09 -36.79 82.75 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.636 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -69.97 -24.94 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -63.94 -24.7 67.83 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.24 -41.93 56.39 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.03 -45.03 83.45 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -70.9 -39.0 73.01 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.418 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 14.2 t70 -58.71 -52.62 64.93 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.1 -26.72 63.16 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.46 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.6 t80 -62.21 -48.61 79.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 67.4 p -62.74 -38.17 89.45 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.95 -29.95 70.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.651 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.36 -48.66 21.96 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.8 -38.0 77.62 Favored 'General case' 0 CA--C 1.491 -1.323 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 73.6 m -65.71 -28.09 68.81 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.509 -0.625 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.725 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.502 -0.898 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -62.1 -41.44 98.21 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -30.39 67.27 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.414 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.4 t60 -65.83 -37.47 86.32 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -60.36 -37.12 79.72 Favored 'General case' 0 CA--C 1.494 -1.175 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.2 m -63.07 -39.77 95.69 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.93 -38.81 72.92 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.414 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.7 t -65.35 -38.16 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -64.94 -37.34 87.33 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.651 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.4 t-80 -63.78 -41.97 97.84 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.1 m -60.13 -46.14 90.66 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.16 -33.66 70.23 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.8 t -66.86 -37.94 85.39 Favored 'General case' 0 CA--C 1.482 -1.664 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.47 -39.32 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.883 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -62.36 -32.44 73.23 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.3 m -94.32 -44.43 7.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.914 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.85 -40.37 64.07 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.647 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.71 69.73 9.41 Favored Pre-proline 0 C--N 1.349 0.568 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 -177.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.264 1.777 0 C-N-CA 122.654 2.236 . . . . 0.0 112.389 179.59 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.7 t70 . . . . . 0 N--CA 1.426 -1.655 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.66 -30.3 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 N-CA-C 107.314 -2.314 . . . . 0.0 107.314 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.4 m -99.73 -33.44 10.58 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.08 -36.53 81.95 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.589 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.05 -25.2 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.9 -24.38 67.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.3 -41.92 55.84 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -57.23 -44.87 84.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.28 -39.08 71.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.431 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.3 t70 -58.75 -52.65 64.78 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -70.7 -27.05 63.7 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.45 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 46.8 t80 -62.01 -48.63 79.42 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.0 p -62.99 -38.32 90.7 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.478 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -65.52 -30.08 70.8 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.652 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.1 t80 -75.42 -49.19 19.68 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.3 mmmt -58.54 -38.66 78.26 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -67.4 -27.31 66.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.8 t . . . . . 0 CA--C 1.507 -0.69 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.613 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.503 -0.865 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.6 m -61.98 -41.5 98.09 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.96 -31.23 68.85 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.413 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.1 t60 -65.8 -37.51 86.46 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.12 -37.23 79.42 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 71.8 m -62.65 -39.71 94.73 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -70.87 -38.92 73.11 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.413 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.8 t -65.76 -38.06 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 44' ' ' CYS . 4.6 mttp -65.39 -37.0 85.67 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.652 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 39.9 t-80 -63.68 -42.05 98.08 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -60.03 -46.25 90.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.36 -33.33 69.47 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 40' ' ' LYS . 27.2 t -66.83 -37.9 85.4 Favored 'General case' 0 CA--C 1.48 -1.719 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.71 -39.46 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.871 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -62.56 -32.57 73.56 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -94.01 -44.35 8.09 Favored 'General case' 0 CA--C 1.509 -0.614 0 C-N-CA 119.65 -0.82 . . . . 0.0 108.938 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.1 -40.12 62.23 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.85 69.82 9.32 Favored Pre-proline 0 C--N 1.349 0.58 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -177.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 C--O 1.262 1.718 0 C-N-CA 122.546 2.164 . . . . 0.0 112.48 179.535 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.424 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 . . . . . 0 N--CA 1.427 -1.591 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.99 -30.69 0.02 OUTLIER Glycine 0 C--N 1.342 0.885 0 N-CA-C 107.354 -2.298 . . . . 0.0 107.354 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 m -99.63 -33.42 10.63 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.64 82.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.59 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.22 -25.27 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -24.14 67.65 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.6 -41.72 53.76 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.27 -44.9 84.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.59 -38.83 70.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.409 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.9 t70 -58.98 -52.41 65.89 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.7 m -70.74 -27.11 63.71 Favored 'General case' 0 CA--C 1.49 -1.337 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.5 t80 -61.85 -48.6 79.82 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.2 p -62.87 -38.4 90.72 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.12 -30.82 71.79 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.66 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.4 -49.52 22.26 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.3 mmmt -58.16 -37.95 75.67 Favored 'General case' 0 CA--C 1.491 -1.321 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.2 t -64.1 -34.98 79.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 18.1 t . . . . . 0 CA--C 1.511 -0.539 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 73.3 tp60 . . . . . 0 CA--C 1.504 -0.802 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -62.9 -40.69 98.34 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.14 -32.64 72.14 Favored 'General case' 0 C--N 1.351 0.66 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.446 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -66.06 -36.91 84.47 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -60.03 -36.31 77.0 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.7 m -62.71 -39.99 95.76 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -71.46 -38.87 71.26 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.446 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -65.55 -37.63 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 44' ' ' CYS . 1.4 mtpp -64.78 -37.16 86.67 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.2 t-80 -64.0 -42.16 97.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.9 m -60.03 -46.48 89.37 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.27 -33.39 69.72 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 40' ' ' LYS . 29.7 t -66.97 -37.84 84.99 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.52 -39.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.826 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -62.55 -32.64 73.63 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.8 m -94.24 -44.37 8.0 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.961 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.9 -40.27 63.6 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.7 69.7 9.41 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.261 1.673 0 C-N-CA 122.674 2.249 . . . . 0.0 112.462 179.665 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 . . . . . 0 N--CA 1.433 -1.315 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.6 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 107.369 -2.293 . . . . 0.0 107.369 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.25 -34.45 10.0 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.65 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.32 -36.48 82.31 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 179.584 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.589 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.41 -24.89 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.48 -24.94 68.04 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -74.99 -41.98 58.44 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -57.26 -44.93 84.37 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -70.94 -38.88 72.87 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 29.8 t70 -58.91 -52.61 64.99 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.2 m -70.77 -27.17 63.73 Favored 'General case' 0 CA--C 1.49 -1.336 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.468 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.4 t80 -61.88 -48.67 79.45 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.7 p -62.77 -37.89 88.43 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.49 -31.24 72.21 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.647 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.9 t80 -74.62 -48.33 27.08 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.7 mmmt -58.76 -37.58 76.56 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -65.11 -28.24 69.3 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.508 -0.656 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 -179.883 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.505 -0.758 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.5 t -62.76 -42.58 99.75 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.23 -30.09 68.17 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.448 ' CD2' HG23 ' A' ' 39' ' ' VAL . 78.2 t60 -65.72 -35.46 80.8 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.03 -35.24 74.67 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 76.5 m -62.31 -40.22 95.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -71.55 -38.82 70.96 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.448 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.7 t -65.17 -37.85 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.443 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 1.4 mtpp -65.08 -37.11 86.45 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.3 t-80 -64.09 -41.65 97.22 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.8 m -60.28 -46.49 89.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.26 -33.53 69.88 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.3 t -66.76 -37.86 85.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.58 -39.27 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.872 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -62.64 -32.31 73.33 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -93.9 -44.71 7.96 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.869 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.26 63.56 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.65 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.62 69.93 9.52 Favored Pre-proline 0 C--N 1.349 0.564 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.263 1.731 0 C-N-CA 122.685 2.256 . . . . 0.0 112.439 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.422 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 . . . . . 0 N--CA 1.427 -1.607 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.87 -30.32 0.02 OUTLIER Glycine 0 C--N 1.341 0.837 0 N-CA-C 107.335 -2.306 . . . . 0.0 107.335 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.8 m -99.86 -33.31 10.6 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.04 -36.36 81.37 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.43 -24.96 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.52 -24.7 67.93 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.21 -42.0 56.5 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.08 -44.87 83.53 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.3 -38.93 71.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.93 -52.45 65.7 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -71.05 -26.77 63.22 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.0 t80 -62.08 -48.61 79.42 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -62.85 -38.15 89.66 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.46 -30.5 71.29 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.1 t80 -75.0 -49.07 21.07 Favored 'General case' 0 N--CA 1.433 -1.294 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.465 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.64 75.85 Favored 'General case' 0 CA--C 1.488 -1.407 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.1 t -63.35 -35.3 79.94 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 CA--C 1.513 -0.458 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.704 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 . . . . . 0 CA--C 1.501 -0.934 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.5 m -62.32 -40.63 96.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -30.95 66.53 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.452 ' CD2' HG21 ' A' ' 39' ' ' VAL . 78.2 t60 -66.57 -35.96 81.48 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -59.76 -35.49 74.71 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 74.6 m -62.08 -40.37 95.58 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -71.95 -38.69 69.75 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.452 HG21 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -64.92 -37.91 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.7 mtpt -64.85 -37.31 87.18 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.7 t-80 -64.13 -41.91 97.02 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.7 m -60.27 -46.59 89.3 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.22 -33.61 70.04 Favored 'General case' 0 C--N 1.343 0.304 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 29.5 t -66.94 -37.82 85.02 Favored 'General case' 0 CA--C 1.483 -1.617 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.69 -39.32 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.758 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.0 m-20 -62.5 -32.48 73.4 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.9 m -93.93 -44.73 7.94 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.965 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.07 -40.27 62.22 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.52 69.99 9.61 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.723 0 C-N-CA 122.687 2.258 . . . . 0.0 112.389 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 . . . . . 0 N--CA 1.427 -1.577 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.4 -30.87 0.02 OUTLIER Glycine 0 C--N 1.343 0.944 0 N-CA-C 107.228 -2.349 . . . . 0.0 107.228 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.2 m -99.55 -33.33 10.69 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.29 -36.62 82.65 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.632 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.596 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.64 -26.1 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.69 -24.14 67.66 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.49 -41.89 54.3 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.39 -44.99 84.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -71.93 -38.49 69.85 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 15.3 t70 -58.43 -52.42 65.7 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -178.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.38 -26.65 62.88 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 -178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.63 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 55.4 t80 -63.05 -47.21 83.96 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.8 p -62.6 -38.14 89.0 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.79 -31.29 72.18 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.465 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.631 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.6 t80 -74.26 -47.28 36.11 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.63 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -58.13 -38.2 76.07 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -67.5 -27.57 67.1 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.508 -0.649 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.72 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 CA--C 1.503 -0.861 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m -61.95 -41.53 98.08 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -30.45 67.33 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.413 ' CD2' HG21 ' A' ' 39' ' ' VAL . 80.9 t60 -65.79 -37.72 87.04 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -60.41 -37.37 80.61 Favored 'General case' 0 CA--C 1.495 -1.162 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.438 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 70.1 m -63.06 -39.63 95.3 Favored 'General case' 0 CA--C 1.495 -1.168 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -70.95 -38.94 72.86 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.413 HG21 ' CD2' ' A' ' 35' ' ' HIS . 55.4 t -65.77 -38.27 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.6 mtpt -65.26 -37.77 88.24 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.631 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.9 t-80 -63.84 -42.06 97.69 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.3 m -60.06 -46.18 90.42 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -71.01 -33.43 70.36 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.424 ' N ' ' O ' ' A' ' 40' ' ' LYS . 33.9 t -66.88 -38.09 85.64 Favored 'General case' 0 CA--C 1.482 -1.645 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.76 -39.52 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.81 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -179.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -63.47 -31.5 72.68 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 85.3 m -91.9 -46.89 7.61 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.728 -0.789 . . . . 0.0 108.891 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.34 -40.27 60.76 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 70.19 11.57 Favored Pre-proline 0 C--N 1.351 0.643 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -177.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 C--O 1.263 1.774 0 C-N-CA 122.564 2.176 . . . . 0.0 112.373 179.487 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.1 t70 . . . . . 0 N--CA 1.427 -1.578 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.82 -30.27 0.02 OUTLIER Glycine 0 C--N 1.341 0.831 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.5 m -99.66 -33.51 10.58 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.1 -36.35 81.46 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.24 -25.4 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.77 -24.59 67.83 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.05 -42.06 57.83 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 179.481 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -57.22 -44.9 84.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.48 -38.55 71.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 31.1 t70 -58.71 -52.89 63.79 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.1 m -70.71 -27.7 64.18 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.518 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.4 t80 -61.42 -48.92 78.99 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.3 -37.36 86.95 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -64.76 -28.6 69.69 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.63 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.7 t80 -81.02 -47.24 13.87 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.518 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.0 mmmt -58.31 -30.31 66.57 Favored 'General case' 0 CA--C 1.48 -1.742 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.44 -35.29 71.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.7 m -62.56 -43.13 99.57 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.1 m -65.66 -38.18 88.6 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.423 ' CD2' HG21 ' A' ' 39' ' ' VAL . 84.6 t60 -64.44 -38.7 91.93 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -59.74 -39.79 85.92 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.02 -37.06 84.94 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.4 t60 -70.12 -37.92 75.45 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.423 HG21 ' CD2' ' A' ' 35' ' ' HIS . 53.6 t -67.13 -37.39 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.7 mttt -64.42 -37.44 87.52 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.63 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 32.7 t-80 -63.99 -42.31 97.25 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.7 m -60.0 -46.34 89.81 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -70.73 -33.45 70.86 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.54 -37.98 86.14 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.34 -39.28 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.816 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -63.24 -31.99 73.27 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.0 m -93.53 -44.95 7.97 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.887 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -39.97 63.02 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.609 -1.397 . . . . 0.0 109.609 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.643 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.01 69.71 9.94 Favored Pre-proline 0 C--N 1.351 0.645 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 C--O 1.26 1.609 0 C-N-CA 122.596 2.198 . . . . 0.0 112.436 179.539 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 . . . . . 0 N--CA 1.426 -1.633 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.54 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.36 -2.296 . . . . 0.0 107.36 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.74 -33.55 10.54 Favored 'General case' 0 CA--C 1.49 -1.332 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.27 -36.79 83.16 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.643 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.1 p -69.81 -25.25 27.9 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.592 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.97 -24.62 67.79 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.22 -42.1 56.23 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 179.521 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -57.31 -44.96 84.61 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.1 t60 -71.1 -39.3 72.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.2 t70 -58.68 -52.19 66.72 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.7 m -71.1 -26.83 63.21 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.622 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 56.0 t80 -62.8 -47.03 85.2 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.7 p -62.83 -38.42 90.7 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.9 mptt -64.74 -31.65 72.98 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.649 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.8 t80 -73.93 -48.44 30.6 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.15 -37.76 72.53 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 t -64.55 -35.56 81.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t . . . . . 0 CA--C 1.514 -0.437 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.503 -0.85 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.0 m -62.1 -41.33 98.1 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.31 -30.26 67.2 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.419 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.74 -37.52 86.61 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -60.37 -37.41 80.67 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.8 m -63.03 -39.72 95.6 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -71.35 -38.51 71.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.419 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.8 t -65.54 -38.28 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.9 mtpt -65.05 -37.43 87.56 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.649 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.2 t-80 -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.6 m -60.18 -45.98 91.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -70.45 -33.87 71.79 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.5 t -66.8 -38.69 86.99 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.12 -39.47 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.851 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -63.53 -30.62 71.71 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -92.45 -46.49 7.63 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 119.652 -0.819 . . . . 0.0 108.961 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.53 -39.75 55.64 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 69.85 11.5 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -177.646 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 C--O 1.263 1.736 0 C-N-CA 122.503 2.135 . . . . 0.0 112.328 179.537 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.4 t70 . . . . . 0 N--CA 1.427 -1.597 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.94 0.02 OUTLIER Glycine 0 C--N 1.341 0.853 0 N-CA-C 107.312 -2.315 . . . . 0.0 107.312 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.3 m -99.76 -33.59 10.51 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.14 -36.51 82.03 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 179.671 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.53 -25.11 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.64 -24.57 67.84 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.26 -42.06 55.92 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.18 -44.83 83.93 Favored 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.69 -39.1 70.45 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.2 t70 -58.8 -52.18 66.8 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -70.92 -27.37 63.72 Favored 'General case' 0 CA--C 1.489 -1.395 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.635 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 53.1 t80 -62.54 -47.19 84.97 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.06 -38.05 89.65 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.22 -31.61 72.86 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.645 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.9 t80 -73.94 -47.85 34.68 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.635 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.32 -37.24 72.2 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -64.02 -36.78 85.1 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.1 t . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.506 -0.731 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.1 m -63.03 -41.69 99.58 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.8 m -67.7 -36.07 79.96 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.45 ' CD2' HG23 ' A' ' 39' ' ' VAL . 79.5 t60 -63.55 -36.42 83.74 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.74 -36.21 76.15 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 72.7 m -62.3 -39.96 94.71 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -72.17 -38.45 69.13 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.45 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.6 t -64.99 -38.11 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.997 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -64.72 -37.57 88.03 Favored 'General case' 0 CA--C 1.486 -1.485 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 40.0 t-80 -64.31 -41.72 96.69 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.9 m -60.35 -46.47 89.83 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.02 -33.57 70.48 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.85 -37.94 85.41 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.41 -39.37 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.833 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -62.59 -32.21 73.17 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -93.97 -44.84 7.87 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.621 -0.831 . . . . 0.0 108.997 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.09 -40.25 62.11 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.15 69.85 9.86 Favored Pre-proline 0 C--N 1.35 0.619 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -177.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 C--O 1.262 1.687 0 C-N-CA 122.686 2.258 . . . . 0.0 112.409 179.675 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.9 t70 . . . . . 0 N--CA 1.432 -1.352 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.33 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 107.41 -2.276 . . . . 0.0 107.41 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.9 m -100.37 -34.37 9.99 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.642 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.42 -36.11 81.35 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.8 -25.22 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -63.46 -24.78 67.97 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.0 -42.22 57.9 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -57.11 -44.95 83.73 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -70.96 -38.46 72.8 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 28.9 t70 -58.7 -53.24 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.6 -27.62 64.23 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.732 -1.211 . . . . 0.0 107.732 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.7 t80 -61.46 -48.91 78.97 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.6 p -63.29 -37.34 86.86 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.02 -28.2 69.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.616 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.2 t80 -81.55 -46.78 13.96 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 22.3 mmmt -58.39 -30.51 66.88 Favored 'General case' 0 CA--C 1.478 -1.825 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.32 -35.03 71.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t . . . . . 0 CA--C 1.507 -0.692 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.996 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.9 m -62.36 -42.42 99.39 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -70.29 -32.15 69.8 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' A' ' 39' ' ' VAL . 84.7 t60 -65.29 -38.53 90.52 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -60.06 -39.28 85.45 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.22 -37.17 84.9 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.15 -38.04 75.37 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.422 HG23 ' CD2' ' A' ' 35' ' ' HIS . 52.9 t -66.99 -37.54 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.4 mttt -64.58 -37.24 86.87 Favored 'General case' 0 CA--C 1.486 -1.491 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.5 t-80 -63.9 -41.74 97.62 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -60.41 -46.38 90.22 Favored 'General case' 0 N--CA 1.436 -1.125 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.04 -33.34 70.21 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 31.5 t -66.38 -38.08 86.73 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.22 -39.37 35.19 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.941 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -63.49 -31.44 72.6 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.7 m -92.93 -45.4 7.98 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.868 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.28 -40.06 61.34 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.642 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -148.47 69.86 10.5 Favored Pre-proline 0 C--N 1.349 0.565 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.907 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.261 1.672 0 C-N-CA 122.67 2.246 . . . . 0.0 112.46 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.1 t70 . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.93 -30.98 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.34 -2.304 . . . . 0.0 107.34 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.9 m -99.51 -33.41 10.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.657 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.2 -36.34 81.64 Favored 'General case' 0 N--CA 1.428 -1.575 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.593 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.4 p -70.56 -25.09 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.587 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.59 -24.56 67.85 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.47 -42.15 53.85 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.556 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.42 -44.99 85.09 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.96 -39.22 72.69 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.99 -52.44 65.77 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.2 m -71.16 -26.65 63.07 Favored 'General case' 0 CA--C 1.49 -1.327 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.7 t80 -61.99 -48.67 79.29 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 65.4 p -62.83 -37.99 88.95 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.85 -30.53 71.16 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.657 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -74.86 -48.66 23.82 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.2 mmmt -58.97 -37.77 77.55 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.7 m -65.38 -28.56 69.35 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.8 t . . . . . 0 CA--C 1.508 -0.645 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.503 -0.841 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.8 m -62.97 -41.39 99.52 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.0 m -66.68 -36.26 82.1 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.415 ' CD2' HG23 ' A' ' 39' ' ' VAL . 81.2 t60 -63.43 -37.26 86.59 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -59.93 -38.14 81.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 68.7 m -63.13 -39.62 95.22 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -70.49 -38.51 74.37 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.415 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -65.59 -37.65 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.75 -37.35 87.32 Favored 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.3 t-80 -64.2 -42.1 96.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 m -60.19 -46.43 89.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.9 -34.03 71.16 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.75 -38.43 86.62 Favored 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -75.64 -39.36 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.763 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -63.28 -31.58 72.76 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.6 m -91.51 -47.17 7.57 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.904 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.27 -40.12 61.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.657 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.19 11.51 Favored Pre-proline 0 C--N 1.35 0.614 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -177.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.631 2.221 . . . . 0.0 112.383 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.405 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 3.4 t70 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -159.29 -31.17 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 -179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 m -100.0 -34.41 10.1 Favored 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.658 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.86 -35.99 81.8 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.607 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.583 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.2 p -70.47 -24.68 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.51 -24.67 67.92 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.13 55.68 Favored 'General case' 0 CA--C 1.495 -1.146 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.44 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.26 -44.85 84.28 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -71.1 -38.99 72.35 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.4 t70 -58.96 -52.44 65.75 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.92 -26.87 63.39 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.477 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.0 -48.54 79.85 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.3 p -62.79 -37.96 88.77 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.89 -30.24 70.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.09 -48.66 22.76 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.68 -37.41 75.99 Favored 'General case' 0 CA--C 1.489 -1.382 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.4 m -64.85 -32.88 74.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.51 -0.56 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -179.766 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.504 -0.82 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.1 m -62.16 -41.04 97.91 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -70.28 -30.88 68.0 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.431 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.3 t60 -66.09 -36.9 84.4 Favored 'General case' 0 CA--C 1.501 -0.918 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -60.05 -36.99 78.52 Favored 'General case' 0 CA--C 1.495 -1.173 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 73.3 m -62.87 -39.84 95.66 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.6 t60 -71.13 -38.76 72.28 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.431 HG22 ' CD2' ' A' ' 35' ' ' HIS . 56.1 t -65.38 -37.98 81.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.077 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -65.05 -37.17 86.71 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.5 t-80 -64.02 -41.82 97.31 Favored 'General case' 0 CA--C 1.497 -1.063 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.3 m -60.31 -46.31 90.34 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.13 -33.89 70.52 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.61 -37.98 86.0 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -76.28 -39.24 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -62.57 -32.18 73.11 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.3 m -94.05 -44.71 7.91 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.88 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.93 -40.26 63.32 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.658 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.36 69.72 9.67 Favored Pre-proline 0 C--N 1.349 0.583 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.638 2.225 . . . . 0.0 112.414 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.4 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 13.9 t70 . . . . . 0 N--CA 1.433 -1.306 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.66 -31.53 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 107.414 -2.274 . . . . 0.0 107.414 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -100.2 -34.7 9.91 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.656 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.66 -36.42 82.8 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -70.29 -25.35 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.54 -24.44 67.81 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.2 -42.3 55.93 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.554 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.17 -44.86 83.9 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.88 -39.31 72.9 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.5 t70 -58.92 -52.24 66.59 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.2 m -70.97 -26.85 63.33 Favored 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.486 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -62.14 -48.44 80.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 72.4 p -62.72 -38.27 89.83 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.28 -31.28 72.34 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 179.597 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.664 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.5 t80 -73.99 -49.16 25.68 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.4 mmmt -58.07 -37.16 73.94 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.3 t -63.48 -37.11 86.03 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.9 t . . . . . 0 C--N 1.348 0.526 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 . . . . . 0 CA--C 1.507 -0.684 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.6 m -62.52 -42.5 99.55 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 86.6 m -67.29 -36.36 81.38 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.46 ' CD2' HG22 ' A' ' 39' ' ' VAL . 79.7 t60 -63.27 -36.33 83.3 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.58 -36.19 75.75 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 69.8 m -62.29 -40.08 95.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -71.6 -38.84 70.82 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.46 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.6 t -65.3 -37.57 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -64.45 -37.62 88.16 Favored 'General case' 0 CA--C 1.486 -1.482 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.664 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.1 t-80 -64.2 -42.2 96.75 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.8 m -60.22 -46.54 89.39 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -70.92 -33.86 70.95 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.7 t -66.99 -37.99 85.22 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.03 -39.48 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.844 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -62.79 -31.84 72.89 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.6 m -93.6 -45.36 7.76 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.672 -0.811 . . . . 0.0 108.949 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.12 -40.25 61.93 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.656 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -148.96 69.17 9.87 Favored Pre-proline 0 C--N 1.349 0.567 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.882 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo . . . . . 0 C--O 1.261 1.644 0 C-N-CA 122.858 2.372 . . . . 0.0 112.698 179.587 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.9 t70 . . . . . 0 N--CA 1.426 -1.647 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.65 -30.63 0.02 OUTLIER Glycine 0 C--N 1.341 0.825 0 N-CA-C 107.295 -2.322 . . . . 0.0 107.295 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 m -99.77 -33.58 10.52 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.633 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.61 82.33 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.632 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.59 -25.55 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -63.72 -24.34 67.73 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.21 -41.87 56.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.05 -44.82 83.36 Favored 'General case' 0 N--CA 1.428 -1.544 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.45 -38.78 71.28 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.02 -52.4 65.94 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.0 m -70.77 -27.09 63.67 Favored 'General case' 0 CA--C 1.49 -1.359 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.459 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.1 t80 -61.8 -48.73 79.31 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.3 p -62.76 -38.04 89.0 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.25 -31.09 72.06 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.8 t80 -74.42 -48.74 25.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.459 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.4 mmmt -58.4 -36.46 73.6 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.1 m -64.12 -34.74 78.75 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.8 t . . . . . 0 C--N 1.349 0.562 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.501 -0.906 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -61.73 -41.12 97.23 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -33.47 72.98 Favored 'General case' 0 C--N 1.352 0.692 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.443 ' CD2' HG23 ' A' ' 39' ' ' VAL . 79.0 t60 -65.34 -37.2 86.35 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -60.14 -36.35 77.32 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.2 m -62.24 -40.18 95.31 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -71.62 -39.12 70.67 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.443 HG23 ' CD2' ' A' ' 35' ' ' HIS . 56.0 t -65.09 -37.45 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.0 mttt -64.62 -37.61 88.15 Favored 'General case' 0 CA--C 1.486 -1.488 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 44.3 t-80 -64.55 -41.85 96.08 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.8 m -60.31 -46.81 88.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.41 -33.21 69.24 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.431 ' N ' ' O ' ' A' ' 40' ' ' LYS . 29.2 t -67.14 -37.84 84.51 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.0 t -76.69 -39.5 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -62.61 -32.37 73.38 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.9 m -94.11 -44.63 7.92 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 119.628 -0.829 . . . . 0.0 108.861 -178.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.88 -40.37 63.8 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.633 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.76 69.95 9.41 Favored Pre-proline 0 C--N 1.35 0.589 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.712 0 C-N-CA 122.648 2.232 . . . . 0.0 112.444 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 . . . . . 0 N--CA 1.427 -1.576 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.85 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.864 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.5 m -99.62 -33.61 10.55 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.641 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.19 -36.69 82.65 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.7 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.595 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.37 -25.14 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.97 -24.27 67.66 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.48 -42.17 53.63 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.471 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -57.38 -44.81 84.75 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -71.31 -39.72 71.26 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.91 -51.81 68.43 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.2 m -70.15 -29.79 66.78 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.507 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 41.5 t80 -61.42 -49.29 77.46 Favored 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 61.9 p -63.44 -38.24 90.37 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -63.45 -29.31 70.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.62 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.6 t80 -80.38 -47.38 14.51 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.4 mmmt -58.02 -30.57 66.22 Favored 'General case' 0 CA--C 1.48 -1.731 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.7 t -58.45 -35.4 72.06 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 40.1 t . . . . . 0 CA--C 1.505 -0.75 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.995 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 . . . . . 0 CA--C 1.508 -0.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.2 m -62.43 -43.15 99.5 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.3 -38.57 90.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.424 ' CD2' HG22 ' A' ' 39' ' ' VAL . 84.0 t60 -64.82 -38.97 92.77 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -59.73 -39.4 84.61 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 56.2 m -65.98 -37.21 85.38 Favored 'General case' 0 CA--C 1.498 -1.058 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -70.5 -37.92 74.23 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.424 HG22 ' CD2' ' A' ' 35' ' ' HIS . 54.8 t -67.25 -37.27 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 44' ' ' CYS . 9.8 mttt -64.07 -37.4 87.31 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.62 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.2 t-80 -64.04 -42.55 97.04 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.7 m -60.06 -46.57 89.12 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -70.8 -33.1 70.37 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' LYS . 34.0 t -66.49 -37.89 86.06 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -76.82 -39.62 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.921 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -63.01 -32.73 74.16 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -93.78 -44.56 8.07 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.907 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.01 -40.19 62.62 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.641 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.23 69.7 9.77 Favored Pre-proline 0 C--N 1.35 0.597 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.261 1.652 0 C-N-CA 122.665 2.244 . . . . 0.0 112.432 179.59 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.418 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 . . . . . 0 N--CA 1.426 -1.628 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.29 0.02 OUTLIER Glycine 0 C--N 1.342 0.901 0 N-CA-C 107.313 -2.315 . . . . 0.0 107.313 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -99.9 -33.43 10.53 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.65 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.13 -36.27 81.27 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.59 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.32 -25.01 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.62 -24.67 67.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.16 -42.07 56.8 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.1 -44.97 83.71 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.17 -39.01 72.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 29.7 t70 -58.98 -52.34 66.16 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 88.7 m -71.09 -27.2 63.44 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.47 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -61.94 -48.5 80.11 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.1 p -62.63 -38.12 89.01 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 -179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.11 -31.78 73.16 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.66 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 7.0 t80 -73.81 -49.21 26.34 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.23 -36.7 73.55 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.5 t -62.23 -36.42 81.94 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 11.3 t . . . . . 0 CA--C 1.511 -0.548 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.509 -0.626 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -63.25 -41.75 99.1 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 37' ' ' CYS . 90.9 m -67.09 -36.14 81.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.454 ' CD2' HG21 ' A' ' 39' ' ' VAL . 78.4 t60 -63.53 -37.12 86.11 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -59.82 -35.16 74.14 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -179.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 84.7 m -62.46 -39.97 95.12 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.9 t60 -73.75 -36.53 65.13 Favored 'General case' 0 CA--C 1.498 -1.031 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.454 HG21 ' CD2' ' A' ' 35' ' ' HIS . 51.1 t -65.82 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.02 -28.02 65.15 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 -179.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.6 t-80 -70.75 -40.45 72.7 Favored 'General case' 0 CA--C 1.49 -1.364 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.2 m -61.18 -46.16 91.66 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.61 -33.55 69.08 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.3 t -66.52 -37.99 86.22 Favored 'General case' 0 CA--C 1.481 -1.674 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.53 -39.39 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.83 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.72 -32.26 73.33 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.4 m -94.03 -44.69 7.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.599 -0.841 . . . . 0.0 108.901 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.2 63.06 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -178.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.65 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.69 69.95 9.47 Favored Pre-proline 0 C--N 1.35 0.6 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -177.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.263 1.743 0 C-N-CA 122.636 2.224 . . . . 0.0 112.416 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.97 0.414 . . . . 0.0 110.162 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 98.3 p -155.59 163.18 40.29 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 55.3 p -75.96 150.98 83.99 Favored Pre-proline 0 N--CA 1.431 -1.402 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.88 -61.51 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.333 0 C-N-CA 122.418 2.079 . . . . 0.0 112.415 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.408 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 13.3 t70 -161.88 -134.94 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 107.192 -1.411 . . . . 0.0 107.192 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.11 -31.27 0.02 OUTLIER Glycine 0 C--N 1.343 0.921 0 N-CA-C 107.366 -2.294 . . . . 0.0 107.366 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.75 -33.74 10.46 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.65 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.66 82.19 Favored 'General case' 0 N--CA 1.428 -1.54 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.6 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.52 -25.91 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.53 -24.66 67.9 Favored 'General case' 0 CA--C 1.504 -0.821 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.14 -42.31 56.49 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -57.4 -45.06 84.94 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -70.86 -39.31 72.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.1 t70 -59.17 -52.06 67.31 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.9 m -70.94 -26.9 63.38 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.459 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.02 -48.37 80.57 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.3 p -62.44 -38.76 91.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.4 mptt -65.14 -31.14 72.18 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.1 t80 -74.3 -49.23 23.86 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.459 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.92 76.41 Favored 'General case' 0 CA--C 1.487 -1.448 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.6 t -62.77 -34.51 77.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.3 t -67.62 -38.35 83.79 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -69.88 -25.39 63.68 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.2 mmt -81.19 -19.11 44.02 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -70.36 163.64 26.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -81.97 7.71 12.41 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.5 m -78.59 -14.78 59.16 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.7 t -89.18 67.84 8.03 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -105.78 -30.11 9.62 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.47 163.77 15.56 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -70.69 -40.5 72.88 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -68.69 -40.98 79.8 Favored 'General case' 0 CA--C 1.5 -0.962 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.6 m -62.05 -40.67 96.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.92 -30.42 63.89 Favored 'General case' 0 C--N 1.349 0.578 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.448 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.2 t60 -65.54 -36.48 83.93 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.86 -36.41 76.8 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 82.5 m -62.42 -40.0 95.12 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -71.38 -38.95 71.5 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.448 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.4 t -65.37 -37.57 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 44' ' ' CYS . 4.4 mttm -64.65 -37.5 87.79 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.3 t-80 -64.48 -42.04 96.13 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -60.55 -46.48 90.02 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -71.07 -33.69 70.47 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.421 ' N ' ' O ' ' A' ' 40' ' ' LYS . 35.3 t -66.92 -38.5 86.32 Favored 'General case' 0 CA--C 1.48 -1.729 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.88 -39.46 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -62.92 -32.23 73.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.0 m -91.71 -46.94 7.64 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.916 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.92 -40.4 63.28 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.65 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.06 11.48 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -177.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 C--O 1.262 1.713 0 C-N-CA 122.616 2.211 . . . . 0.0 112.393 179.48 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.034 0.445 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.0 t -151.76 146.84 26.03 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.401 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 32.9 m -78.63 130.47 70.85 Favored Pre-proline 0 N--CA 1.437 -1.097 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.587 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 66.3 Cg_exo -52.32 -42.7 58.84 Favored 'Trans proline' 0 CA--C 1.498 -1.309 0 C-N-CA 122.622 2.214 . . . . 0.0 112.847 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.41 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.2 t70 -155.08 -133.85 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.67 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.36 -34.45 9.96 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.653 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.3 -36.32 81.76 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.592 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -70.49 -24.84 25.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -179.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.78 -24.35 67.73 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.37 -42.07 54.88 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.32 -44.85 84.54 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -71.05 -39.16 72.43 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.2 t70 -59.0 -52.31 66.3 Favored 'General case' 0 C--O 1.219 -0.515 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.1 m -70.97 -27.0 63.41 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.479 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.1 t80 -61.98 -48.6 79.61 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.78 -37.91 88.51 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.53 -31.15 72.06 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.659 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.32 -48.65 26.94 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.479 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.27 -37.08 74.27 Favored 'General case' 0 CA--C 1.488 -1.423 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -63.22 -34.54 77.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t -69.28 -37.14 77.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -69.28 -23.93 63.9 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.8 mmt -84.9 -16.35 41.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.8 m -68.12 160.13 29.59 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.21 1.84 23.22 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -80.93 -10.56 59.7 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.7 t -91.84 70.32 5.6 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.7 p80 -115.43 -34.03 5.07 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -105.36 151.1 24.61 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.93 -39.16 93.52 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.46 -44.2 79.21 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.7 m -63.14 -41.66 99.34 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.6 m -67.36 -36.03 80.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.444 ' CD2' HG22 ' A' ' 39' ' ' VAL . 79.3 t60 -63.47 -36.18 82.89 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -59.62 -36.75 76.93 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.3 m -62.23 -39.98 94.63 Favored 'General case' 0 CA--C 1.496 -1.11 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -71.44 -38.62 71.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.444 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -65.07 -37.52 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.989 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -64.76 -37.32 87.21 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.6 t-80 -64.23 -41.89 96.81 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.8 m -60.24 -46.33 90.16 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.98 -33.93 70.9 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.93 -37.9 85.18 Favored 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.29 -39.3 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -62.5 -32.36 73.27 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -94.07 -44.68 7.91 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.896 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.27 63.5 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.653 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.48 69.85 9.61 Favored Pre-proline 0 C--N 1.349 0.581 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 -177.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.677 2.252 . . . . 0.0 112.444 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.02 0.438 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.8 t -152.3 146.93 25.78 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.6 m -78.05 130.69 71.84 Favored Pre-proline 0 N--CA 1.437 -1.077 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.58 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 59.7 Cg_exo -52.33 -43.03 56.92 Favored 'Trans proline' 0 CA--C 1.497 -1.362 0 C-N-CA 122.645 2.23 . . . . 0.0 112.762 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.7 t70 -156.17 -133.38 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.66 -31.56 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 N-CA-C 107.305 -2.318 . . . . 0.0 107.305 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.0 m -100.39 -34.24 10.04 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.36 -36.21 81.52 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.63 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.587 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.69 -24.82 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.548 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.52 -24.66 67.91 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.06 55.82 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.24 -44.85 84.22 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -71.04 -39.11 72.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.411 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 29.3 t70 -58.96 -52.48 65.57 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.7 m -70.94 -26.89 63.38 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.466 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.03 -48.54 79.79 Favored 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.2 p -62.94 -38.08 89.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.68 -30.25 70.91 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -75.16 -49.09 20.62 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.29 -37.99 76.11 Favored 'General case' 0 CA--C 1.49 -1.356 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.9 t -63.66 -35.32 80.16 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 16.6 t -66.62 -38.94 88.0 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -70.34 -22.45 62.8 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 34.9 mmt -85.54 -15.85 41.37 Favored 'General case' 0 CA--C 1.491 -1.325 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.0 m -70.45 162.05 29.42 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -87.9 13.69 10.36 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.0 m -81.56 -8.48 59.72 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.2 t -86.76 78.8 9.02 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -87.01 -28.24 22.75 Favored 'General case' 0 CA--C 1.5 -0.972 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.8 t0 -139.93 175.09 9.88 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.52 -37.63 85.43 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -63.23 -40.85 98.63 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.427 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 71.1 m -62.23 -41.25 98.23 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -30.87 68.28 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.427 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.2 t60 -66.07 -37.14 85.08 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -60.29 -37.15 79.59 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.5 m -62.9 -39.89 95.89 Favored 'General case' 0 CA--C 1.497 -1.068 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -71.03 -38.79 72.58 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.427 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.3 t -65.18 -37.92 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -65.11 -37.16 86.57 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.4 t-80 -64.03 -41.66 97.34 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.6 m -60.16 -46.56 89.27 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.29 -33.68 69.95 Favored 'General case' 0 C--N 1.344 0.349 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.0 t -66.8 -37.88 85.41 Favored 'General case' 0 CA--C 1.482 -1.653 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.5 -39.32 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.799 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -62.64 -32.29 73.3 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.0 m -94.02 -44.61 7.97 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 119.643 -0.823 . . . . 0.0 108.923 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.34 62.97 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -178.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.59 69.97 9.55 Favored Pre-proline 0 C--N 1.349 0.571 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -177.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.262 1.692 0 C-N-CA 122.646 2.231 . . . . 0.0 112.393 179.672 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 121.087 0.47 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.9 t -152.94 145.81 24.46 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -78.76 129.51 73.54 Favored Pre-proline 0 N--CA 1.439 -1.013 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -64.47 -62.55 0.09 OUTLIER 'Trans proline' 0 CA--C 1.498 -1.314 0 C-N-CA 122.322 2.015 . . . . 0.0 112.498 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 -162.82 -133.85 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.583 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.48 -30.4 0.02 OUTLIER Glycine 0 C--N 1.341 0.844 0 N-CA-C 107.309 -2.317 . . . . 0.0 107.309 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.4 m -99.74 -33.35 10.62 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.653 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.591 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -69.94 -25.23 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -24.17 67.61 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.44 -41.64 55.35 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -57.35 -44.89 84.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -71.22 -38.95 71.98 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.421 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 21.8 t70 -58.97 -52.41 65.87 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.1 m -70.84 -26.78 63.43 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.463 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.06 -48.44 80.24 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.72 -38.7 91.51 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.483 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -64.85 -31.16 72.26 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.658 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.4 t80 -74.03 -49.67 23.19 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.8 mmmt -58.29 -37.83 75.81 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.3 t -63.37 -34.85 78.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.1 t -66.55 -39.4 88.52 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -70.49 -23.19 62.63 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 34.6 mmt -83.79 -17.49 40.93 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.0 m -71.45 163.2 28.15 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -88.23 13.68 10.97 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -80.14 -9.06 59.69 Favored 'General case' 0 CA--C 1.486 -1.499 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.3 t -87.19 78.95 8.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -87.19 -30.18 21.19 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.2 t0 -138.32 175.9 9.17 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.47 -38.26 86.92 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.74 -40.64 97.23 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.466 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.2 m -61.97 -41.29 97.85 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -31.22 68.5 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.425 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.5 t60 -65.78 -37.4 86.2 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -60.21 -36.99 78.91 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 82.6 m -62.84 -39.97 96.01 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -71.2 -38.67 72.07 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.425 HG23 ' CD2' ' A' ' 35' ' ' HIS . 56.0 t -65.32 -38.04 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.5 mtpt -64.81 -37.37 87.4 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.658 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.6 t-80 -63.85 -42.14 97.64 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.8 m -60.18 -46.14 90.71 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.03 -33.73 70.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.1 t -66.94 -37.94 85.24 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.33 -39.22 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.828 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -62.53 -32.51 73.46 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -94.25 -44.4 7.98 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 119.549 -0.86 . . . . 0.0 108.885 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -40.16 62.76 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.653 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.62 69.74 9.48 Favored Pre-proline 0 C--N 1.35 0.593 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 -177.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.652 2.234 . . . . 0.0 112.398 179.646 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 120.977 0.418 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.8 m -131.19 148.61 52.73 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 32.3 m -79.16 130.57 68.91 Favored Pre-proline 0 N--CA 1.437 -1.084 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.586 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 65.4 Cg_exo -52.07 -42.71 57.41 Favored 'Trans proline' 0 CA--C 1.497 -1.337 0 C-N-CA 122.513 2.142 . . . . 0.0 112.795 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 16.4 t70 -155.81 -133.0 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.31 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.68 -31.6 0.02 OUTLIER Glycine 0 CA--C 1.501 -0.819 0 N-CA-C 107.38 -2.288 . . . . 0.0 107.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.0 m -100.58 -34.33 9.94 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.647 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.09 -36.79 82.75 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.636 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -69.97 -24.94 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -63.94 -24.7 67.83 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.24 -41.93 56.39 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.03 -45.03 83.45 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -70.9 -39.0 73.01 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.418 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 14.2 t70 -58.71 -52.62 64.93 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.1 -26.72 63.16 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.46 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.6 t80 -62.21 -48.61 79.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 67.4 p -62.74 -38.17 89.45 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.424 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.95 -29.95 70.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.651 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.36 -48.66 21.96 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.8 -38.0 77.62 Favored 'General case' 0 CA--C 1.491 -1.323 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 73.6 m -65.71 -28.09 68.81 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 14.3 t -71.35 -39.27 71.41 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -70.53 -22.83 62.58 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.5 mmt -83.46 -17.52 41.76 Favored 'General case' 0 CA--C 1.492 -1.28 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.1 m -70.58 162.79 28.24 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -88.0 13.41 11.09 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -81.45 -8.81 59.78 Favored 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.1 t -87.78 79.29 8.2 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -86.92 -29.61 21.97 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.9 t0 -139.32 175.98 9.1 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.32 -38.03 86.73 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.37 -40.69 97.94 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.445 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.7 m -62.1 -41.44 98.21 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -30.39 67.27 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.414 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.4 t60 -65.83 -37.47 86.32 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -60.36 -37.12 79.72 Favored 'General case' 0 CA--C 1.494 -1.175 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.2 m -63.07 -39.77 95.69 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.93 -38.81 72.92 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.414 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.7 t -65.35 -38.16 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -64.94 -37.34 87.33 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.651 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.4 t-80 -63.78 -41.97 97.84 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.1 m -60.13 -46.14 90.66 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.16 -33.66 70.23 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.8 t -66.86 -37.94 85.39 Favored 'General case' 0 CA--C 1.482 -1.664 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.47 -39.32 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.883 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -62.36 -32.44 73.23 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.3 m -94.32 -44.43 7.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.914 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.85 -40.37 64.07 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.647 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.71 69.73 9.41 Favored Pre-proline 0 C--N 1.349 0.568 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 -177.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.264 1.777 0 C-N-CA 122.654 2.236 . . . . 0.0 112.389 179.59 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.031 0.443 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -132.31 148.42 52.43 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.8 m -79.54 129.12 72.69 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -63.84 -62.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.384 2.056 . . . . 0.0 112.493 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.7 t70 -162.46 -133.75 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.66 -30.3 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 N-CA-C 107.314 -2.314 . . . . 0.0 107.314 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.4 m -99.73 -33.44 10.58 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.08 -36.53 81.95 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.589 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.05 -25.2 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.9 -24.38 67.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.3 -41.92 55.84 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -57.23 -44.87 84.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.28 -39.08 71.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.431 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.3 t70 -58.75 -52.65 64.78 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -70.7 -27.05 63.7 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.45 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 46.8 t80 -62.01 -48.63 79.42 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.0 p -62.99 -38.32 90.7 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.478 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -65.52 -30.08 70.8 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.652 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.1 t80 -75.42 -49.19 19.68 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.3 mmmt -58.54 -38.66 78.26 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -67.4 -27.31 66.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.8 t -71.02 -40.53 71.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.458 ' CD ' ' HH ' ' A' ' 19' ' ' TYR . 12.8 mt-30 -71.14 -22.9 62.01 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.3 mmt -83.23 -17.0 44.24 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.0 m -70.91 163.97 26.36 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -86.74 12.74 10.1 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.6 m -80.99 -8.98 59.89 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.0 t -87.87 79.47 8.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -85.52 -28.61 24.83 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' H ' ' HB2' ' A' ' 33' ' ' SER . 2.2 t0 -140.99 175.95 9.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -65.93 -37.98 87.46 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -63.04 -40.73 98.59 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.451 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.6 m -61.98 -41.5 98.09 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.96 -31.23 68.85 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.413 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.1 t60 -65.8 -37.51 86.46 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.12 -37.23 79.42 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 71.8 m -62.65 -39.71 94.73 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -70.87 -38.92 73.11 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.413 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.8 t -65.76 -38.06 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 44' ' ' CYS . 4.6 mttp -65.39 -37.0 85.67 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.652 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 39.9 t-80 -63.68 -42.05 98.08 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -60.03 -46.25 90.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.36 -33.33 69.47 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 40' ' ' LYS . 27.2 t -66.83 -37.9 85.4 Favored 'General case' 0 CA--C 1.48 -1.719 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.71 -39.46 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.871 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -62.56 -32.57 73.56 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -94.01 -44.35 8.09 Favored 'General case' 0 CA--C 1.509 -0.614 0 C-N-CA 119.65 -0.82 . . . . 0.0 108.938 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.1 -40.12 62.23 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.85 69.82 9.32 Favored Pre-proline 0 C--N 1.349 0.58 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -177.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 C--O 1.262 1.718 0 C-N-CA 122.546 2.164 . . . . 0.0 112.48 179.535 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 121.023 0.439 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -152.98 145.09 23.82 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.5 m -79.33 129.61 71.6 Favored Pre-proline 0 N--CA 1.439 -1.012 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -63.0 -62.17 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.343 2.029 . . . . 0.0 112.441 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.424 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 -161.93 -133.56 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.99 -30.69 0.02 OUTLIER Glycine 0 C--N 1.342 0.885 0 N-CA-C 107.354 -2.298 . . . . 0.0 107.354 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 m -99.63 -33.42 10.63 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.64 82.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.59 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.22 -25.27 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -24.14 67.65 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.6 -41.72 53.76 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.27 -44.9 84.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.59 -38.83 70.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.409 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.9 t70 -58.98 -52.41 65.89 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.7 m -70.74 -27.11 63.71 Favored 'General case' 0 CA--C 1.49 -1.337 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.5 t80 -61.85 -48.6 79.82 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.2 p -62.87 -38.4 90.72 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.12 -30.82 71.79 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.66 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.4 -49.52 22.26 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.3 mmmt -58.16 -37.95 75.67 Favored 'General case' 0 CA--C 1.491 -1.321 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.2 t -64.1 -34.98 79.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 18.1 t -66.6 -39.22 88.28 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.97 -23.12 63.12 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.9 mmt -86.08 -16.13 39.05 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -70.94 162.68 28.94 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -87.98 13.96 9.95 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.6 m -80.55 -8.83 59.73 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -87.01 78.71 8.92 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.61 -28.65 23.12 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' H ' ' HB2' ' A' ' 33' ' ' SER . 5.1 t0 -140.06 175.3 9.7 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.52 -37.64 85.46 Favored 'General case' 0 CA--C 1.505 -0.778 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 73.3 tp60 -63.0 -41.66 99.65 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.427 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.5 m -62.9 -40.69 98.34 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.14 -32.64 72.14 Favored 'General case' 0 C--N 1.351 0.66 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.446 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -66.06 -36.91 84.47 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -60.03 -36.31 77.0 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.7 m -62.71 -39.99 95.76 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -71.46 -38.87 71.26 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.446 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -65.55 -37.63 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 44' ' ' CYS . 1.4 mtpp -64.78 -37.16 86.67 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.2 t-80 -64.0 -42.16 97.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.9 m -60.03 -46.48 89.37 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.27 -33.39 69.72 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 40' ' ' LYS . 29.7 t -66.97 -37.84 84.99 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.52 -39.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.826 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -62.55 -32.64 73.63 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.8 m -94.24 -44.37 8.0 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.961 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.9 -40.27 63.6 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.7 69.7 9.41 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.261 1.673 0 C-N-CA 122.674 2.249 . . . . 0.0 112.462 179.665 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.989 0.424 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 t -151.87 146.31 25.57 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 31.6 m -79.06 129.99 71.14 Favored Pre-proline 0 N--CA 1.436 -1.134 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.587 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 66.0 Cg_exo -52.2 -42.56 59.04 Favored 'Trans proline' 0 CA--C 1.498 -1.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.857 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 -154.97 -133.88 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.6 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 107.369 -2.293 . . . . 0.0 107.369 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.25 -34.45 10.0 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.65 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.32 -36.48 82.31 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 179.584 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.589 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.41 -24.89 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.48 -24.94 68.04 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -74.99 -41.98 58.44 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -57.26 -44.93 84.37 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -70.94 -38.88 72.87 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 29.8 t70 -58.91 -52.61 64.99 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.2 m -70.77 -27.17 63.73 Favored 'General case' 0 CA--C 1.49 -1.336 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.468 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.4 t80 -61.88 -48.67 79.45 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.7 p -62.77 -37.89 88.43 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.49 -31.24 72.21 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.647 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.9 t80 -74.62 -48.33 27.08 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.7 mmmt -58.76 -37.58 76.56 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -65.11 -28.24 69.3 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 9.5 t -71.54 -38.54 71.02 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -70.69 -23.5 62.49 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.0 mmt -81.76 -17.57 47.24 Favored 'General case' 0 CA--C 1.49 -1.353 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.8 m -69.72 163.78 24.93 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -84.11 7.21 19.52 Favored 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -81.2 -10.8 59.56 Favored 'General case' 0 CA--C 1.495 -1.154 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.32 71.64 8.15 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -109.44 -33.99 6.66 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -111.06 153.02 26.23 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.703 -1.591 . . . . 0.0 106.703 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.35 -39.44 92.36 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.34 -42.42 83.56 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.5 t -62.76 -42.58 99.75 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.23 -30.09 68.17 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.448 ' CD2' HG23 ' A' ' 39' ' ' VAL . 78.2 t60 -65.72 -35.46 80.8 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.03 -35.24 74.67 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 76.5 m -62.31 -40.22 95.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -71.55 -38.82 70.96 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.448 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.7 t -65.17 -37.85 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.443 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 1.4 mtpp -65.08 -37.11 86.45 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.3 t-80 -64.09 -41.65 97.22 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.8 m -60.28 -46.49 89.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.26 -33.53 69.88 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.3 t -66.76 -37.86 85.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.58 -39.27 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.872 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -62.64 -32.31 73.33 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -93.9 -44.71 7.96 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.869 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.26 63.56 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.65 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.62 69.93 9.52 Favored Pre-proline 0 C--N 1.349 0.564 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.263 1.731 0 C-N-CA 122.685 2.256 . . . . 0.0 112.439 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 120.97 0.414 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -153.46 146.07 24.19 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.2 m -78.73 129.13 74.85 Favored Pre-proline 0 N--CA 1.438 -1.039 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.03 -62.86 0.09 OUTLIER 'Trans proline' 0 CA--C 1.496 -1.384 0 C-N-CA 122.312 2.008 . . . . 0.0 112.514 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.422 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 -162.4 -133.76 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.87 -30.32 0.02 OUTLIER Glycine 0 C--N 1.341 0.837 0 N-CA-C 107.335 -2.306 . . . . 0.0 107.335 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.8 m -99.86 -33.31 10.6 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.04 -36.36 81.37 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.43 -24.96 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.52 -24.7 67.93 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.21 -42.0 56.5 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.08 -44.87 83.53 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.3 -38.93 71.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.93 -52.45 65.7 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -71.05 -26.77 63.22 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.0 t80 -62.08 -48.61 79.42 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -62.85 -38.15 89.66 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.46 -30.5 71.29 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.1 t80 -75.0 -49.07 21.07 Favored 'General case' 0 N--CA 1.433 -1.294 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.465 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.64 75.85 Favored 'General case' 0 CA--C 1.488 -1.407 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.1 t -63.35 -35.3 79.94 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.5 t -66.39 -38.81 88.36 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -70.45 -23.08 62.64 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.4 mmt -83.76 -16.9 43.01 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -70.38 163.42 26.68 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -83.76 9.17 12.49 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.6 m -80.21 -11.91 59.69 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.1 t -88.05 68.14 9.09 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -102.78 -29.12 11.67 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.6 163.47 16.76 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -70.68 -39.85 73.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -67.38 -41.27 85.31 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.5 m -62.32 -40.63 96.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -30.95 66.53 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.452 ' CD2' HG21 ' A' ' 39' ' ' VAL . 78.2 t60 -66.57 -35.96 81.48 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -59.76 -35.49 74.71 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 74.6 m -62.08 -40.37 95.58 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -71.95 -38.69 69.75 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.452 HG21 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -64.92 -37.91 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.7 mtpt -64.85 -37.31 87.18 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.7 t-80 -64.13 -41.91 97.02 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.7 m -60.27 -46.59 89.3 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.22 -33.61 70.04 Favored 'General case' 0 C--N 1.343 0.304 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 29.5 t -66.94 -37.82 85.02 Favored 'General case' 0 CA--C 1.483 -1.617 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.69 -39.32 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.758 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.0 m-20 -62.5 -32.48 73.4 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.9 m -93.93 -44.73 7.94 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.965 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.07 -40.27 62.22 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.52 69.99 9.61 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.723 0 C-N-CA 122.687 2.258 . . . . 0.0 112.389 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 121.048 0.452 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -153.02 145.42 24.06 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.1 m -78.46 128.77 76.71 Favored Pre-proline 0 N--CA 1.437 -1.079 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.94 -62.0 0.11 Allowed 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.296 1.997 . . . . 0.0 112.559 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 -162.47 -133.79 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.577 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.4 -30.87 0.02 OUTLIER Glycine 0 C--N 1.343 0.944 0 N-CA-C 107.228 -2.349 . . . . 0.0 107.228 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.2 m -99.55 -33.33 10.69 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.29 -36.62 82.65 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.632 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.596 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.64 -26.1 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.69 -24.14 67.66 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.49 -41.89 54.3 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.39 -44.99 84.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -71.93 -38.49 69.85 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 15.3 t70 -58.43 -52.42 65.7 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -178.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.38 -26.65 62.88 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 -178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.63 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 55.4 t80 -63.05 -47.21 83.96 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.8 p -62.6 -38.14 89.0 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.79 -31.29 72.18 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.465 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.631 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.6 t80 -74.26 -47.28 36.11 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.63 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -58.13 -38.2 76.07 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -67.5 -27.57 67.1 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.2 -38.78 72.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -71.23 -22.93 61.93 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.5 mmt -82.8 -17.74 42.99 Favored 'General case' 0 CA--C 1.493 -1.221 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -70.47 161.35 30.73 Favored 'General case' 0 CA--C 1.502 -0.904 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -88.79 13.24 12.96 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 m -81.72 -8.91 59.75 Favored 'General case' 0 CA--C 1.488 -1.427 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 t -87.17 79.13 8.7 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -86.77 -28.73 22.82 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -138.93 175.28 9.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.75 -37.39 84.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -63.02 -41.0 99.44 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m -61.95 -41.53 98.08 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -30.45 67.33 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.413 ' CD2' HG21 ' A' ' 39' ' ' VAL . 80.9 t60 -65.79 -37.72 87.04 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -60.41 -37.37 80.61 Favored 'General case' 0 CA--C 1.495 -1.162 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.438 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 70.1 m -63.06 -39.63 95.3 Favored 'General case' 0 CA--C 1.495 -1.168 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -70.95 -38.94 72.86 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.413 HG21 ' CD2' ' A' ' 35' ' ' HIS . 55.4 t -65.77 -38.27 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.6 mtpt -65.26 -37.77 88.24 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.631 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.9 t-80 -63.84 -42.06 97.69 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.3 m -60.06 -46.18 90.42 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -71.01 -33.43 70.36 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.424 ' N ' ' O ' ' A' ' 40' ' ' LYS . 33.9 t -66.88 -38.09 85.64 Favored 'General case' 0 CA--C 1.482 -1.645 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.76 -39.52 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.81 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -179.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -63.47 -31.5 72.68 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 85.3 m -91.9 -46.89 7.61 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.728 -0.789 . . . . 0.0 108.891 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.34 -40.27 60.76 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 70.19 11.57 Favored Pre-proline 0 C--N 1.351 0.643 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -177.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 C--O 1.263 1.774 0 C-N-CA 122.564 2.176 . . . . 0.0 112.373 179.487 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 121.082 0.467 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m -131.91 148.02 52.51 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.8 m -79.57 129.49 71.3 Favored Pre-proline 0 N--CA 1.44 -0.945 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.02 -62.61 0.09 OUTLIER 'Trans proline' 0 CA--C 1.498 -1.302 0 C-N-CA 122.415 2.077 . . . . 0.0 112.416 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.417 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.1 t70 -162.78 -133.7 0.02 OUTLIER 'General case' 0 N--CA 1.427 -1.578 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.82 -30.27 0.02 OUTLIER Glycine 0 C--N 1.341 0.831 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.5 m -99.66 -33.51 10.58 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.1 -36.35 81.46 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.24 -25.4 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.77 -24.59 67.83 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.05 -42.06 57.83 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 179.481 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -57.22 -44.9 84.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.48 -38.55 71.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 31.1 t70 -58.71 -52.89 63.79 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.1 m -70.71 -27.7 64.18 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.518 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.4 t80 -61.42 -48.92 78.99 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.3 -37.36 86.95 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -64.76 -28.6 69.69 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.63 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.7 t80 -81.02 -47.24 13.87 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.518 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.0 mmmt -58.31 -30.31 66.57 Favored 'General case' 0 CA--C 1.48 -1.742 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.44 -35.29 71.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.0 t -69.57 -42.06 75.01 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -64.74 -25.19 67.82 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.5 mmt -84.86 -21.07 29.92 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.7 m -77.5 167.3 21.86 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -87.9 6.48 35.41 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.0 m -80.76 -12.23 59.49 Favored 'General case' 0 CA--C 1.494 -1.193 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.8 t -93.46 66.81 3.94 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -111.47 -32.78 6.59 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.91 146.66 28.35 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.56 -38.72 91.99 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 107.769 -1.196 . . . . 0.0 107.769 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -66.84 -44.93 79.8 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.7 m -62.56 -43.13 99.57 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.1 m -65.66 -38.18 88.6 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.423 ' CD2' HG21 ' A' ' 39' ' ' VAL . 84.6 t60 -64.44 -38.7 91.93 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -59.74 -39.79 85.92 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.02 -37.06 84.94 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.4 t60 -70.12 -37.92 75.45 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.423 HG21 ' CD2' ' A' ' 35' ' ' HIS . 53.6 t -67.13 -37.39 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.7 mttt -64.42 -37.44 87.52 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.63 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 32.7 t-80 -63.99 -42.31 97.25 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.7 m -60.0 -46.34 89.81 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -70.73 -33.45 70.86 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.54 -37.98 86.14 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.34 -39.28 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.816 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -63.24 -31.99 73.27 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.0 m -93.53 -44.95 7.97 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.887 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -39.97 63.02 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.609 -1.397 . . . . 0.0 109.609 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.643 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.01 69.71 9.94 Favored Pre-proline 0 C--N 1.351 0.645 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 C--O 1.26 1.609 0 C-N-CA 122.596 2.198 . . . . 0.0 112.436 179.539 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.052 0.453 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 95.1 p -155.5 160.2 40.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.9 m -81.44 129.38 66.33 Favored Pre-proline 0 N--CA 1.438 -1.031 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -62.36 -61.42 0.15 Allowed 'Trans proline' 0 CA--C 1.496 -1.379 0 C-N-CA 122.379 2.053 . . . . 0.0 112.48 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 -161.98 -134.03 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.633 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.54 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.36 -2.296 . . . . 0.0 107.36 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.74 -33.55 10.54 Favored 'General case' 0 CA--C 1.49 -1.332 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.27 -36.79 83.16 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.643 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.1 p -69.81 -25.25 27.9 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.592 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.97 -24.62 67.79 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.22 -42.1 56.23 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 179.521 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -57.31 -44.96 84.61 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.1 t60 -71.1 -39.3 72.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.2 t70 -58.68 -52.19 66.72 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.7 m -71.1 -26.83 63.21 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.622 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 56.0 t80 -62.8 -47.03 85.2 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.7 p -62.83 -38.42 90.7 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.9 mptt -64.74 -31.65 72.98 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.649 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.8 t80 -73.93 -48.44 30.6 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.15 -37.76 72.53 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 t -64.55 -35.56 81.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t -67.03 -38.38 85.78 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -70.23 -22.71 62.88 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.4 mmt -86.22 -15.93 39.32 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -71.26 162.24 29.76 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.3 13.18 12.13 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -80.76 -9.01 59.84 Favored 'General case' 0 CA--C 1.485 -1.548 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -87.79 79.77 8.06 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -86.91 -29.56 22.03 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.7 t0 -139.49 176.32 8.82 Favored 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.13 -38.14 87.43 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.39 -40.84 98.33 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.451 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.0 m -62.1 -41.33 98.1 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.31 -30.26 67.2 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.419 ' CD2' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.74 -37.52 86.61 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -60.37 -37.41 80.67 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.8 m -63.03 -39.72 95.6 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -71.35 -38.51 71.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.419 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.8 t -65.54 -38.28 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.9 mtpt -65.05 -37.43 87.56 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.649 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.2 t-80 -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.6 m -60.18 -45.98 91.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -70.45 -33.87 71.79 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.5 t -66.8 -38.69 86.99 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.12 -39.47 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.851 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -63.53 -30.62 71.71 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -92.45 -46.49 7.63 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 119.652 -0.819 . . . . 0.0 108.961 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.53 -39.75 55.64 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 69.85 11.5 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -177.646 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 C--O 1.263 1.736 0 C-N-CA 122.503 2.135 . . . . 0.0 112.328 179.537 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.6 t -152.84 145.57 24.32 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.5 m -79.37 129.48 71.95 Favored Pre-proline 0 N--CA 1.437 -1.102 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -62.65 -61.79 0.13 Allowed 'Trans proline' 0 CA--C 1.497 -1.364 0 C-N-CA 122.379 2.053 . . . . 0.0 112.417 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.4 t70 -161.33 -134.05 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.94 0.02 OUTLIER Glycine 0 C--N 1.341 0.853 0 N-CA-C 107.312 -2.315 . . . . 0.0 107.312 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.3 m -99.76 -33.59 10.51 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.14 -36.51 82.03 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 179.671 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.53 -25.11 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.64 -24.57 67.84 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.26 -42.06 55.92 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.18 -44.83 83.93 Favored 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.69 -39.1 70.45 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.2 t70 -58.8 -52.18 66.8 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -70.92 -27.37 63.72 Favored 'General case' 0 CA--C 1.489 -1.395 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.635 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 53.1 t80 -62.54 -47.19 84.97 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.06 -38.05 89.65 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.22 -31.61 72.86 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.645 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.9 t80 -73.94 -47.85 34.68 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.635 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.32 -37.24 72.2 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -64.02 -36.78 85.1 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.1 t -67.61 -37.16 82.12 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -69.32 -24.42 63.92 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.0 mmt -86.15 -16.17 38.73 Favored 'General case' 0 CA--C 1.493 -1.231 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.4 m -68.11 161.5 26.75 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.17 2.34 24.64 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.9 m -80.52 -11.77 59.62 Favored 'General case' 0 CA--C 1.493 -1.226 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.2 t -91.15 69.15 6.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -114.34 -33.55 5.59 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.52 154.45 20.85 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.94 -39.51 90.54 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.02 -43.59 78.46 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.1 m -63.03 -41.69 99.58 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.8 m -67.7 -36.07 79.96 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.45 ' CD2' HG23 ' A' ' 39' ' ' VAL . 79.5 t60 -63.55 -36.42 83.74 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.74 -36.21 76.15 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 72.7 m -62.3 -39.96 94.71 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -72.17 -38.45 69.13 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.45 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.6 t -64.99 -38.11 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.997 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -64.72 -37.57 88.03 Favored 'General case' 0 CA--C 1.486 -1.485 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 40.0 t-80 -64.31 -41.72 96.69 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.9 m -60.35 -46.47 89.83 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.02 -33.57 70.48 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.85 -37.94 85.41 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.41 -39.37 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.833 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -62.59 -32.21 73.17 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -93.97 -44.84 7.87 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.621 -0.831 . . . . 0.0 108.997 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.09 -40.25 62.11 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.15 69.85 9.86 Favored Pre-proline 0 C--N 1.35 0.619 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -177.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 C--O 1.262 1.687 0 C-N-CA 122.686 2.258 . . . . 0.0 112.409 179.675 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.035 0.445 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.1 t -152.63 147.01 25.64 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.41 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 30.9 m -78.0 130.48 72.61 Favored Pre-proline 0 N--CA 1.438 -1.032 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.578 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 68.3 Cg_exo -52.35 -42.55 59.92 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.556 2.171 . . . . 0.0 112.853 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.9 t70 -155.73 -134.09 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.33 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 107.41 -2.276 . . . . 0.0 107.41 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.9 m -100.37 -34.37 9.99 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.642 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.42 -36.11 81.35 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.588 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.8 -25.22 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -63.46 -24.78 67.97 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.0 -42.22 57.9 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -57.11 -44.95 83.73 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -70.96 -38.46 72.8 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 28.9 t70 -58.7 -53.24 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.6 -27.62 64.23 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.732 -1.211 . . . . 0.0 107.732 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.7 t80 -61.46 -48.91 78.97 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.6 p -63.29 -37.34 86.86 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.02 -28.2 69.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.616 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.2 t80 -81.55 -46.78 13.96 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 22.3 mmmt -58.39 -30.51 66.88 Favored 'General case' 0 CA--C 1.478 -1.825 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.32 -35.03 71.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -69.86 -41.88 74.25 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -64.88 -26.91 68.52 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.27 -23.41 35.29 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.0 m -76.38 169.78 17.59 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.75 9.82 25.78 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.6 m -79.82 -11.4 59.83 Favored 'General case' 0 CA--C 1.492 -1.265 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.07 63.37 3.7 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -102.15 -33.0 9.83 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -110.92 149.47 30.59 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 35' ' ' HIS . 98.9 mt-10 -65.72 -38.44 89.16 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.06 -43.13 83.45 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.9 m -62.36 -42.42 99.39 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -70.29 -32.15 69.8 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' A' ' 39' ' ' VAL . 84.7 t60 -65.29 -38.53 90.52 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -60.06 -39.28 85.45 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.22 -37.17 84.9 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.15 -38.04 75.37 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.422 HG23 ' CD2' ' A' ' 35' ' ' HIS . 52.9 t -66.99 -37.54 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.4 mttt -64.58 -37.24 86.87 Favored 'General case' 0 CA--C 1.486 -1.491 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.5 t-80 -63.9 -41.74 97.62 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -60.41 -46.38 90.22 Favored 'General case' 0 N--CA 1.436 -1.125 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.04 -33.34 70.21 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 31.5 t -66.38 -38.08 86.73 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.22 -39.37 35.19 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.941 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -63.49 -31.44 72.6 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.7 m -92.93 -45.4 7.98 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.868 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.28 -40.06 61.34 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.642 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -148.47 69.86 10.5 Favored Pre-proline 0 C--N 1.349 0.565 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.907 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.261 1.672 0 C-N-CA 122.67 2.246 . . . . 0.0 112.46 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 120.983 0.42 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -153.52 145.42 23.56 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -78.11 129.47 75.47 Favored Pre-proline 0 N--CA 1.438 -1.025 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.81 -62.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.497 -1.348 0 C-N-CA 122.332 2.021 . . . . 0.0 112.508 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.1 t70 -162.01 -134.28 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.93 -30.98 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.34 -2.304 . . . . 0.0 107.34 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.9 m -99.51 -33.41 10.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.657 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.2 -36.34 81.64 Favored 'General case' 0 N--CA 1.428 -1.575 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.593 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.4 p -70.56 -25.09 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.587 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.59 -24.56 67.85 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.47 -42.15 53.85 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.556 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.42 -44.99 85.09 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.96 -39.22 72.69 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.99 -52.44 65.77 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.2 m -71.16 -26.65 63.07 Favored 'General case' 0 CA--C 1.49 -1.327 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.7 t80 -61.99 -48.67 79.29 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 65.4 p -62.83 -37.99 88.95 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.85 -30.53 71.16 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.657 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -74.86 -48.66 23.82 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.2 mmmt -58.97 -37.77 77.55 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.7 m -65.38 -28.56 69.35 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.8 t -71.5 -39.01 71.11 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -71.43 -22.84 61.79 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.2 mmt -84.33 -16.94 41.17 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -70.81 163.91 26.32 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -87.1 19.86 2.94 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.2 m -90.82 -6.98 53.56 Favored 'General case' 0 CA--C 1.478 -1.797 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.88 75.56 8.06 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 106.503 -1.665 . . . . 0.0 106.503 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -89.84 -32.63 16.82 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -136.25 174.46 10.59 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' HIS . 99.2 mt-10 -67.2 -37.07 83.04 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.52 -43.12 98.09 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.8 m -62.97 -41.39 99.52 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.0 m -66.68 -36.26 82.1 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.415 ' CD2' HG23 ' A' ' 39' ' ' VAL . 81.2 t60 -63.43 -37.26 86.59 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -59.93 -38.14 81.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 68.7 m -63.13 -39.62 95.22 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -70.49 -38.51 74.37 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.415 HG23 ' CD2' ' A' ' 35' ' ' HIS . 55.9 t -65.59 -37.65 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.75 -37.35 87.32 Favored 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.3 t-80 -64.2 -42.1 96.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 m -60.19 -46.43 89.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.9 -34.03 71.16 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.75 -38.43 86.62 Favored 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -75.64 -39.36 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.763 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -63.28 -31.58 72.76 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.6 m -91.51 -47.17 7.57 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.904 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.27 -40.12 61.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.657 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.19 11.51 Favored Pre-proline 0 C--N 1.35 0.614 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -177.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.631 2.221 . . . . 0.0 112.383 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.976 0.417 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 t -152.81 146.5 25.11 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 30.1 m -78.39 130.81 70.46 Favored Pre-proline 0 N--CA 1.437 -1.095 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.576 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 72.1 Cg_exo -52.06 -42.62 57.86 Favored 'Trans proline' 0 CA--C 1.497 -1.35 0 C-N-CA 122.633 2.222 . . . . 0.0 112.795 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.405 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 3.4 t70 -154.93 -138.63 0.07 Allowed 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -159.29 -31.17 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 -179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 m -100.0 -34.41 10.1 Favored 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.658 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.86 -35.99 81.8 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.607 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.583 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.2 p -70.47 -24.68 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.51 -24.67 67.92 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.13 55.68 Favored 'General case' 0 CA--C 1.495 -1.146 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.44 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.26 -44.85 84.28 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -71.1 -38.99 72.35 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.4 t70 -58.96 -52.44 65.75 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.92 -26.87 63.39 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.477 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.0 -48.54 79.85 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.3 p -62.79 -37.96 88.77 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.89 -30.24 70.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.09 -48.66 22.76 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.68 -37.41 75.99 Favored 'General case' 0 CA--C 1.489 -1.382 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.4 m -64.85 -32.88 74.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.5 t -68.83 -39.05 80.2 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -70.94 -21.37 62.36 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 14.5 mtm -89.13 -5.52 57.71 Favored 'General case' 0 CA--C 1.487 -1.442 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.1 m -79.98 164.82 23.17 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.04 13.03 13.92 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.9 m -82.28 -8.37 59.64 Favored 'General case' 0 CA--C 1.487 -1.455 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.5 t -86.84 79.03 8.93 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -87.28 -29.36 21.69 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.9 t0 -139.28 175.49 9.52 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -66.47 -38.01 86.38 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.444 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.1 m -62.16 -41.04 97.91 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -70.28 -30.88 68.0 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.431 ' CD2' HG22 ' A' ' 39' ' ' VAL . 80.3 t60 -66.09 -36.9 84.4 Favored 'General case' 0 CA--C 1.501 -0.918 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -60.05 -36.99 78.52 Favored 'General case' 0 CA--C 1.495 -1.173 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 73.3 m -62.87 -39.84 95.66 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.6 t60 -71.13 -38.76 72.28 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.431 HG22 ' CD2' ' A' ' 35' ' ' HIS . 56.1 t -65.38 -37.98 81.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.077 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -65.05 -37.17 86.71 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.5 t-80 -64.02 -41.82 97.31 Favored 'General case' 0 CA--C 1.497 -1.063 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.3 m -60.31 -46.31 90.34 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.13 -33.89 70.52 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.61 -37.98 86.0 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -76.28 -39.24 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -62.57 -32.18 73.11 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.3 m -94.05 -44.71 7.91 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.88 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.93 -40.26 63.32 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.658 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.36 69.72 9.67 Favored Pre-proline 0 C--N 1.349 0.583 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.638 2.225 . . . . 0.0 112.414 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.743 0 CA-C-O 121.01 0.433 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.1 p -155.03 160.97 41.44 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.9 m -82.16 130.0 61.69 Favored Pre-proline 0 N--CA 1.437 -1.077 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.591 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 69.6 Cg_exo -52.21 -42.49 59.48 Favored 'Trans proline' 0 CA--C 1.498 -1.29 0 C-N-CA 122.621 2.214 . . . . 0.0 112.773 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.4 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 13.9 t70 -154.61 -134.72 0.05 OUTLIER 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.66 -31.53 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 107.414 -2.274 . . . . 0.0 107.414 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -100.2 -34.7 9.91 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.656 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.66 -36.42 82.8 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -70.29 -25.35 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.54 -24.44 67.81 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.2 -42.3 55.93 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.554 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.17 -44.86 83.9 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.88 -39.31 72.9 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 30.5 t70 -58.92 -52.24 66.59 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.2 m -70.97 -26.85 63.33 Favored 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.486 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -62.14 -48.44 80.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 72.4 p -62.72 -38.27 89.83 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.28 -31.28 72.34 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 179.597 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.664 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.5 t80 -73.99 -49.16 25.68 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.4 mmmt -58.07 -37.16 73.94 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.3 t -63.48 -37.11 86.03 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.9 t -67.18 -37.34 83.54 Favored 'General case' 0 C--N 1.348 0.526 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.8 mm100 -69.81 -19.95 63.47 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 13.9 mtm -90.37 -3.15 57.91 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.5 p -73.9 166.57 23.11 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -86.46 1.53 51.09 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -87.37 -8.2 56.87 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.9 t -87.48 65.56 8.67 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.757 -1.572 . . . . 0.0 106.757 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.8 p80 -114.51 -30.91 6.39 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -104.04 149.83 24.82 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -64.77 -39.14 93.11 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -67.42 -44.35 79.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.6 m -62.52 -42.5 99.55 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 86.6 m -67.29 -36.36 81.38 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.46 ' CD2' HG22 ' A' ' 39' ' ' VAL . 79.7 t60 -63.27 -36.33 83.3 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.58 -36.19 75.75 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 69.8 m -62.29 -40.08 95.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -71.6 -38.84 70.82 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.46 HG22 ' CD2' ' A' ' 35' ' ' HIS . 55.6 t -65.3 -37.57 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -64.45 -37.62 88.16 Favored 'General case' 0 CA--C 1.486 -1.482 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.664 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.1 t-80 -64.2 -42.2 96.75 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.8 m -60.22 -46.54 89.39 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -70.92 -33.86 70.95 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.7 t -66.99 -37.99 85.22 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.03 -39.48 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.844 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -62.79 -31.84 72.89 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.6 m -93.6 -45.36 7.76 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.672 -0.811 . . . . 0.0 108.949 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.12 -40.25 61.93 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.656 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -148.96 69.17 9.87 Favored Pre-proline 0 C--N 1.349 0.567 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.882 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo . . . . . 0 C--O 1.261 1.644 0 C-N-CA 122.858 2.372 . . . . 0.0 112.698 179.587 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 120.997 0.427 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 t -153.16 145.3 23.81 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.8 m -79.23 129.16 73.41 Favored Pre-proline 0 N--CA 1.437 -1.103 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.85 -62.71 0.1 Allowed 'Trans proline' 0 CA--C 1.497 -1.361 0 C-N-CA 122.366 2.044 . . . . 0.0 112.518 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.9 t70 -161.47 -133.8 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.65 -30.63 0.02 OUTLIER Glycine 0 C--N 1.341 0.825 0 N-CA-C 107.295 -2.322 . . . . 0.0 107.295 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 m -99.77 -33.58 10.52 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.633 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.61 82.33 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.632 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.594 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.59 -25.55 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -63.72 -24.34 67.73 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.21 -41.87 56.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.05 -44.82 83.36 Favored 'General case' 0 N--CA 1.428 -1.544 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.45 -38.78 71.28 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.02 -52.4 65.94 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.0 m -70.77 -27.09 63.67 Favored 'General case' 0 CA--C 1.49 -1.359 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.459 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.1 t80 -61.8 -48.73 79.31 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.3 p -62.76 -38.04 89.0 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.25 -31.09 72.06 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.654 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.8 t80 -74.42 -48.74 25.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.459 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.4 mmmt -58.4 -36.46 73.6 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.1 m -64.12 -34.74 78.75 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.8 t -69.84 -37.39 76.16 Favored 'General case' 0 C--N 1.349 0.562 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -68.15 -24.85 65.03 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 73.4 mtm -93.41 -2.85 54.17 Favored 'General case' 0 CA--C 1.487 -1.468 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -78.86 163.43 25.3 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.18 14.06 13.53 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.4 m -82.73 -7.34 59.66 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.7 t -86.33 78.64 9.26 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -87.94 -27.55 22.06 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.442 ' H ' ' HB2' ' A' ' 33' ' ' SER . 3.6 t0 -139.1 173.99 10.98 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.69 -37.93 85.74 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.42 -40.63 97.71 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.442 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 71.0 m -61.73 -41.12 97.23 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -33.47 72.98 Favored 'General case' 0 C--N 1.352 0.692 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.443 ' CD2' HG23 ' A' ' 39' ' ' VAL . 79.0 t60 -65.34 -37.2 86.35 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -60.14 -36.35 77.32 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.2 m -62.24 -40.18 95.31 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -71.62 -39.12 70.67 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.443 HG23 ' CD2' ' A' ' 35' ' ' HIS . 56.0 t -65.09 -37.45 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.0 mttt -64.62 -37.61 88.15 Favored 'General case' 0 CA--C 1.486 -1.488 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 44.3 t-80 -64.55 -41.85 96.08 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.8 m -60.31 -46.81 88.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.41 -33.21 69.24 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.431 ' N ' ' O ' ' A' ' 40' ' ' LYS . 29.2 t -67.14 -37.84 84.51 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.0 t -76.69 -39.5 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -62.61 -32.37 73.38 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.9 m -94.11 -44.63 7.92 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 119.628 -0.829 . . . . 0.0 108.861 -178.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.88 -40.37 63.8 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.633 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.76 69.95 9.41 Favored Pre-proline 0 C--N 1.35 0.589 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.712 0 C-N-CA 122.648 2.232 . . . . 0.0 112.444 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.063 0.458 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -131.55 147.49 52.54 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.7 m -80.5 129.34 69.26 Favored Pre-proline 0 N--CA 1.438 -1.049 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.76 -62.19 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.373 0 C-N-CA 122.344 2.029 . . . . 0.0 112.461 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 -161.36 -133.64 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.85 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.864 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.5 m -99.62 -33.61 10.55 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.641 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.19 -36.69 82.65 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.7 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.595 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.37 -25.14 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.97 -24.27 67.66 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.48 -42.17 53.63 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.471 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -57.38 -44.81 84.75 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -71.31 -39.72 71.26 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.91 -51.81 68.43 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.2 m -70.15 -29.79 66.78 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.507 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 41.5 t80 -61.42 -49.29 77.46 Favored 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 61.9 p -63.44 -38.24 90.37 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -63.45 -29.31 70.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.62 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.6 t80 -80.38 -47.38 14.51 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.4 mmmt -58.02 -30.57 66.22 Favored 'General case' 0 CA--C 1.48 -1.731 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.7 t -58.45 -35.4 72.06 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 40.1 t -69.45 -41.99 75.51 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.66 -25.58 68.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 -179.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.5 mmt -84.87 -21.21 29.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.4 m -77.37 167.03 22.37 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -87.99 6.01 38.0 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.0 m -80.13 -12.58 59.65 Favored 'General case' 0 CA--C 1.495 -1.167 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.8 t -92.67 65.28 4.27 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -110.79 -32.1 6.96 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -103.12 146.22 28.72 Favored 'General case' 0 CA--C 1.487 -1.473 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -64.73 -38.83 92.33 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -66.87 -44.96 79.58 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.2 m -62.43 -43.15 99.5 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.3 -38.57 90.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.424 ' CD2' HG22 ' A' ' 39' ' ' VAL . 84.0 t60 -64.82 -38.97 92.77 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -59.73 -39.4 84.61 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 56.2 m -65.98 -37.21 85.38 Favored 'General case' 0 CA--C 1.498 -1.058 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -70.5 -37.92 74.23 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.424 HG22 ' CD2' ' A' ' 35' ' ' HIS . 54.8 t -67.25 -37.27 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 44' ' ' CYS . 9.8 mttt -64.07 -37.4 87.31 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.62 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.2 t-80 -64.04 -42.55 97.04 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.7 m -60.06 -46.57 89.12 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -70.8 -33.1 70.37 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' LYS . 34.0 t -66.49 -37.89 86.06 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -76.82 -39.62 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.921 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -63.01 -32.73 74.16 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -93.78 -44.56 8.07 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.907 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.01 -40.19 62.62 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.641 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.23 69.7 9.77 Favored Pre-proline 0 C--N 1.35 0.597 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.261 1.652 0 C-N-CA 122.665 2.244 . . . . 0.0 112.432 179.59 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.07 0.462 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.0 p -156.25 160.69 40.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.8 m -81.45 127.43 73.37 Favored Pre-proline 0 N--CA 1.439 -1.009 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.51 -63.63 0.06 OUTLIER 'Trans proline' 0 CA--C 1.499 -1.259 0 C-N-CA 122.402 2.068 . . . . 0.0 112.537 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.418 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 -161.98 -133.79 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.628 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.29 0.02 OUTLIER Glycine 0 C--N 1.342 0.901 0 N-CA-C 107.313 -2.315 . . . . 0.0 107.313 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -99.9 -33.43 10.53 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.65 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.13 -36.27 81.27 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.59 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.32 -25.01 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.62 -24.67 67.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.16 -42.07 56.8 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.1 -44.97 83.71 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.17 -39.01 72.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 29.7 t70 -58.98 -52.34 66.16 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 88.7 m -71.09 -27.2 63.44 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.47 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -61.94 -48.5 80.11 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.1 p -62.63 -38.12 89.01 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 -179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.11 -31.78 73.16 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.66 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 7.0 t80 -73.81 -49.21 26.34 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.23 -36.7 73.55 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.5 t -62.23 -36.42 81.94 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 11.3 t -68.46 -37.69 80.42 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -68.69 -24.35 64.49 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.3 mmt -85.85 -16.17 39.52 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -69.0 160.66 30.53 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.54 2.11 23.37 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.5 m -80.59 -10.66 59.73 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.91 69.92 5.51 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -115.37 -33.64 5.22 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -105.47 150.97 24.84 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.97 -39.05 93.26 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -67.51 -44.27 78.83 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -63.25 -41.75 99.1 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 37' ' ' CYS . 90.9 m -67.09 -36.14 81.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.454 ' CD2' HG21 ' A' ' 39' ' ' VAL . 78.4 t60 -63.53 -37.12 86.11 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -59.82 -35.16 74.14 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -179.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 84.7 m -62.46 -39.97 95.12 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.9 t60 -73.75 -36.53 65.13 Favored 'General case' 0 CA--C 1.498 -1.031 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.454 HG21 ' CD2' ' A' ' 35' ' ' HIS . 51.1 t -65.82 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.02 -28.02 65.15 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 -179.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.6 t-80 -70.75 -40.45 72.7 Favored 'General case' 0 CA--C 1.49 -1.364 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.2 m -61.18 -46.16 91.66 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.61 -33.55 69.08 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.3 t -66.52 -37.99 86.22 Favored 'General case' 0 CA--C 1.481 -1.674 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.53 -39.39 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.83 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -62.72 -32.26 73.33 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.4 m -94.03 -44.69 7.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.599 -0.841 . . . . 0.0 108.901 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.2 63.06 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -178.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.65 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.69 69.95 9.47 Favored Pre-proline 0 C--N 1.35 0.6 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -177.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.263 1.743 0 C-N-CA 122.636 2.224 . . . . 0.0 112.416 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 t70 . . . . . 0 N--CA 1.427 -1.62 0 N-CA-C 107.192 -1.411 . . . . 0.0 107.192 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.11 -31.27 0.02 OUTLIER Glycine 0 C--N 1.343 0.921 0 N-CA-C 107.366 -2.294 . . . . 0.0 107.366 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.75 -33.74 10.46 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.637 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.66 82.19 Favored 'General case' 0 N--CA 1.428 -1.54 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.562 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.52 -25.91 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.53 -24.66 67.9 Favored 'General case' 0 CA--C 1.504 -0.821 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.14 -42.31 56.49 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.4 -45.06 84.94 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -70.86 -39.31 72.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.1 t70 -59.17 -52.06 67.31 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.9 m -70.94 -26.9 63.38 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.02 -48.37 80.57 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.3 p -62.44 -38.76 91.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.4 mptt -65.14 -31.14 72.18 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.1 t80 -74.3 -49.23 23.86 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.92 76.41 Favored 'General case' 0 CA--C 1.487 -1.448 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.6 t -62.77 -34.51 77.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.3 t . . . . . 0 C--N 1.348 0.522 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.5 -0.962 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.6 m -62.05 -40.67 96.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.92 -30.42 63.89 Favored 'General case' 0 C--N 1.349 0.578 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.422 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -65.54 -36.48 83.93 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.86 -36.41 76.8 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 82.5 m -62.42 -40.0 95.12 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -71.38 -38.95 71.5 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.37 -37.57 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttm -64.65 -37.5 87.79 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.8 t60 -64.48 -42.04 96.13 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.1 m -60.55 -46.48 90.02 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -71.07 -33.69 70.47 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.3 t -66.92 -38.5 86.32 Favored 'General case' 0 CA--C 1.48 -1.729 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.88 -39.46 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.481 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.92 -32.23 73.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.0 m -91.71 -46.94 7.64 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.916 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.92 -40.4 63.28 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.637 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.06 11.48 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -177.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 C--O 1.262 1.713 0 C-N-CA 122.616 2.211 . . . . 0.0 112.393 179.48 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.2 t70 . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.67 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.36 -34.45 9.96 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.639 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.3 -36.32 81.76 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.613 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -70.49 -24.84 25.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -179.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.78 -24.35 67.73 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.37 -42.07 54.88 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.32 -44.85 84.54 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -71.05 -39.16 72.43 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.0 -52.31 66.3 Favored 'General case' 0 C--O 1.219 -0.515 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.1 m -70.97 -27.0 63.41 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.46 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.1 t80 -61.98 -48.6 79.61 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.78 -37.91 88.51 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.53 -31.15 72.06 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.642 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.32 -48.65 26.94 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.27 -37.08 74.27 Favored 'General case' 0 CA--C 1.488 -1.423 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -63.22 -34.54 77.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t . . . . . 0 CA--C 1.51 -0.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.7 m -63.14 -41.66 99.34 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.6 m -67.36 -36.03 80.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.3 t60 -63.47 -36.18 82.89 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -59.62 -36.75 76.93 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.3 m -62.23 -39.98 94.63 Favored 'General case' 0 CA--C 1.496 -1.11 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -71.44 -38.62 71.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.07 -37.52 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.989 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -64.76 -37.32 87.21 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.642 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.3 t60 -64.23 -41.89 96.81 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.461 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.8 m -60.24 -46.33 90.16 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.98 -33.93 70.9 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.93 -37.9 85.18 Favored 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.29 -39.3 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.461 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.0 m-20 -62.5 -32.36 73.27 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -94.07 -44.68 7.91 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.896 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.27 63.5 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.639 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.48 69.85 9.61 Favored Pre-proline 0 C--N 1.349 0.581 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 -177.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.677 2.252 . . . . 0.0 112.444 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.432 -1.373 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.66 -31.56 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 N-CA-C 107.305 -2.318 . . . . 0.0 107.305 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.0 m -100.39 -34.24 10.04 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.36 -36.21 81.52 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.63 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.547 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.69 -24.82 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.548 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.52 -24.66 67.91 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.06 55.82 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.24 -44.85 84.22 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -71.04 -39.11 72.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.96 -52.48 65.57 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.7 m -70.94 -26.89 63.38 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.03 -48.54 79.79 Favored 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.2 p -62.94 -38.08 89.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.68 -30.25 70.91 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.633 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -75.16 -49.09 20.62 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.29 -37.99 76.11 Favored 'General case' 0 CA--C 1.49 -1.356 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.9 t -63.66 -35.32 80.16 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 16.6 t . . . . . 0 C--N 1.348 0.514 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 -179.7 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.503 -0.827 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.1 m -62.23 -41.25 98.23 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -30.87 68.28 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.453 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -66.07 -37.14 85.08 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -60.29 -37.15 79.59 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.5 m -62.9 -39.89 95.89 Favored 'General case' 0 CA--C 1.497 -1.068 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -71.03 -38.79 72.58 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.3 t -65.18 -37.92 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -65.11 -37.16 86.57 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.633 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.0 t60 -64.03 -41.66 97.34 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.453 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.16 -46.56 89.27 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.29 -33.68 69.95 Favored 'General case' 0 C--N 1.344 0.349 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.0 t -66.8 -37.88 85.41 Favored 'General case' 0 CA--C 1.482 -1.653 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.5 -39.32 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.799 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.453 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.4 m-20 -62.64 -32.29 73.3 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.0 m -94.02 -44.61 7.97 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 119.643 -0.823 . . . . 0.0 108.923 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.34 62.97 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -178.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.59 69.97 9.55 Favored Pre-proline 0 C--N 1.349 0.571 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -177.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.262 1.692 0 C-N-CA 122.646 2.231 . . . . 0.0 112.393 179.672 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 . . . . . 0 N--CA 1.427 -1.583 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.48 -30.4 0.02 OUTLIER Glycine 0 C--N 1.341 0.844 0 N-CA-C 107.309 -2.317 . . . . 0.0 107.309 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.4 m -99.74 -33.35 10.62 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -69.94 -25.23 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -24.17 67.61 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.44 -41.64 55.35 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -57.35 -44.89 84.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -71.22 -38.95 71.98 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 21.8 t70 -58.97 -52.41 65.87 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.1 m -70.84 -26.78 63.43 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.06 -48.44 80.24 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.72 -38.7 91.51 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -64.85 -31.16 72.26 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.4 t80 -74.03 -49.67 23.19 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.8 mmmt -58.29 -37.83 75.81 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.3 t -63.37 -34.85 78.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.1 t . . . . . 0 CA--C 1.512 -0.494 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.701 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.501 -0.924 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -61.97 -41.29 97.85 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -31.22 68.5 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.458 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.5 t60 -65.78 -37.4 86.2 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -60.21 -36.99 78.91 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 82.6 m -62.84 -39.97 96.01 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -71.2 -38.67 72.07 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.32 -38.04 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.5 mtpt -64.81 -37.37 87.4 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.6 t60 -63.85 -42.14 97.64 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.8 m -60.18 -46.14 90.71 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.03 -33.73 70.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.1 t -66.94 -37.94 85.24 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.33 -39.22 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.828 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.6 m-20 -62.53 -32.51 73.46 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -94.25 -44.4 7.98 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 119.549 -0.86 . . . . 0.0 108.885 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -40.16 62.76 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.64 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.62 69.74 9.48 Favored Pre-proline 0 C--N 1.35 0.593 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 -177.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.652 2.234 . . . . 0.0 112.398 179.646 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 N--CA 1.433 -1.31 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.68 -31.6 0.02 OUTLIER Glycine 0 CA--C 1.501 -0.819 0 N-CA-C 107.38 -2.288 . . . . 0.0 107.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.0 m -100.58 -34.33 9.94 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.633 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.09 -36.79 82.75 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.636 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -69.97 -24.94 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -63.94 -24.7 67.83 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.24 -41.93 56.39 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.03 -45.03 83.45 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -70.9 -39.0 73.01 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -58.71 -52.62 64.93 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.1 -26.72 63.16 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.6 t80 -62.21 -48.61 79.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 67.4 p -62.74 -38.17 89.45 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.95 -29.95 70.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.626 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.36 -48.66 21.96 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.8 -38.0 77.62 Favored 'General case' 0 CA--C 1.491 -1.323 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 73.6 m -65.71 -28.09 68.81 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.509 -0.625 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.725 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.502 -0.898 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -62.1 -41.44 98.21 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -30.39 67.27 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.461 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -65.83 -37.47 86.32 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -60.36 -37.12 79.72 Favored 'General case' 0 CA--C 1.494 -1.175 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.2 m -63.07 -39.77 95.69 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.93 -38.81 72.92 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.7 t -65.35 -38.16 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -64.94 -37.34 87.33 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.4 t60 -63.78 -41.97 97.84 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.477 HG22 ' ND2' ' A' ' 46' ' ' ASN . 33.1 m -60.13 -46.14 90.66 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.16 -33.66 70.23 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.8 t -66.86 -37.94 85.39 Favored 'General case' 0 CA--C 1.482 -1.664 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.47 -39.32 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.883 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.477 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.1 m-20 -62.36 -32.44 73.23 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.3 m -94.32 -44.43 7.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.914 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.85 -40.37 64.07 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.633 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.71 69.73 9.41 Favored Pre-proline 0 C--N 1.349 0.568 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 -177.933 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.264 1.777 0 C-N-CA 122.654 2.236 . . . . 0.0 112.389 179.59 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.7 t70 . . . . . 0 N--CA 1.426 -1.655 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.66 -30.3 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 N-CA-C 107.314 -2.314 . . . . 0.0 107.314 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.4 m -99.73 -33.44 10.58 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.08 -36.53 81.95 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.05 -25.2 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.9 -24.38 67.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.3 -41.92 55.84 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -57.23 -44.87 84.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.28 -39.08 71.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.3 t70 -58.75 -52.65 64.78 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -70.7 -27.05 63.7 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.432 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 46.8 t80 -62.01 -48.63 79.42 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.0 p -62.99 -38.32 90.7 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -65.52 -30.08 70.8 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.1 t80 -75.42 -49.19 19.68 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.3 mmmt -58.54 -38.66 78.26 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -67.4 -27.31 66.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.8 t . . . . . 0 CA--C 1.507 -0.69 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.613 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.503 -0.865 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.6 m -61.98 -41.5 98.09 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.96 -31.23 68.85 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.438 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.1 t60 -65.8 -37.51 86.46 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.12 -37.23 79.42 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 71.8 m -62.65 -39.71 94.73 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -70.87 -38.92 73.11 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.76 -38.06 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -65.39 -37.0 85.67 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 75.9 t60 -63.68 -42.05 98.08 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.466 HG22 ' ND2' ' A' ' 46' ' ' ASN . 35.7 m -60.03 -46.25 90.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.36 -33.33 69.47 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 t -66.83 -37.9 85.4 Favored 'General case' 0 CA--C 1.48 -1.719 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.71 -39.46 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.871 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.466 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.56 -32.57 73.56 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -178.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -94.01 -44.35 8.09 Favored 'General case' 0 CA--C 1.509 -0.614 0 C-N-CA 119.65 -0.82 . . . . 0.0 108.938 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.1 -40.12 62.23 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.85 69.82 9.32 Favored Pre-proline 0 C--N 1.349 0.58 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -177.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 C--O 1.262 1.718 0 C-N-CA 122.546 2.164 . . . . 0.0 112.48 179.535 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 . . . . . 0 N--CA 1.427 -1.591 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.99 -30.69 0.02 OUTLIER Glycine 0 C--N 1.342 0.885 0 N-CA-C 107.354 -2.298 . . . . 0.0 107.354 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 m -99.63 -33.42 10.63 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.64 82.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.22 -25.27 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -24.14 67.65 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.6 -41.72 53.76 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.27 -44.9 84.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.59 -38.83 70.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.98 -52.41 65.89 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.7 m -70.74 -27.11 63.71 Favored 'General case' 0 CA--C 1.49 -1.337 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.423 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.5 t80 -61.85 -48.6 79.82 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.2 p -62.87 -38.4 90.72 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.12 -30.82 71.79 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.645 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.4 -49.52 22.26 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.3 mmmt -58.16 -37.95 75.67 Favored 'General case' 0 CA--C 1.491 -1.321 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.2 t -64.1 -34.98 79.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 18.1 t . . . . . 0 CA--C 1.511 -0.539 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 73.3 tp60 . . . . . 0 CA--C 1.504 -0.802 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -62.9 -40.69 98.34 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.14 -32.64 72.14 Favored 'General case' 0 C--N 1.351 0.66 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.423 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -66.06 -36.91 84.47 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -60.03 -36.31 77.0 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.7 m -62.71 -39.99 95.76 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -71.46 -38.87 71.26 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.55 -37.63 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -64.78 -37.16 86.67 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.8 t60 -64.0 -42.16 97.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.456 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.9 m -60.03 -46.48 89.37 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.27 -33.39 69.72 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.7 t -66.97 -37.84 84.99 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.52 -39.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.826 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.456 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -62.55 -32.64 73.63 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.8 m -94.24 -44.37 8.0 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.961 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.9 -40.27 63.6 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.7 69.7 9.41 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.261 1.673 0 C-N-CA 122.674 2.249 . . . . 0.0 112.462 179.665 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.433 -1.315 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.6 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 107.369 -2.293 . . . . 0.0 107.369 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.25 -34.45 10.0 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.32 -36.48 82.31 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 179.584 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.549 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.41 -24.89 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.48 -24.94 68.04 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -74.99 -41.98 58.44 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -57.26 -44.93 84.37 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -70.94 -38.88 72.87 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.91 -52.61 64.99 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.2 m -70.77 -27.17 63.73 Favored 'General case' 0 CA--C 1.49 -1.336 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.45 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.4 t80 -61.88 -48.67 79.45 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.7 p -62.77 -37.89 88.43 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.49 -31.24 72.21 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.9 t80 -74.62 -48.33 27.08 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.7 mmmt -58.76 -37.58 76.56 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -65.11 -28.24 69.3 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.508 -0.656 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 -179.883 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.505 -0.758 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.5 t -62.76 -42.58 99.75 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.23 -30.09 68.17 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -65.72 -35.46 80.8 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.03 -35.24 74.67 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 76.5 m -62.31 -40.22 95.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -71.55 -38.82 70.96 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.17 -37.85 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 1.4 mtpp -65.08 -37.11 86.45 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.5 t60 -64.09 -41.65 97.22 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.457 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.8 m -60.28 -46.49 89.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.26 -33.53 69.88 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.3 t -66.76 -37.86 85.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.58 -39.27 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.872 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.457 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.5 m-20 -62.64 -32.31 73.33 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -93.9 -44.71 7.96 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.869 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.26 63.56 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.62 69.93 9.52 Favored Pre-proline 0 C--N 1.349 0.564 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.263 1.731 0 C-N-CA 122.685 2.256 . . . . 0.0 112.439 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 . . . . . 0 N--CA 1.427 -1.607 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.87 -30.32 0.02 OUTLIER Glycine 0 C--N 1.341 0.837 0 N-CA-C 107.335 -2.306 . . . . 0.0 107.335 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.8 m -99.86 -33.31 10.6 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.04 -36.36 81.37 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.548 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.43 -24.96 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.52 -24.7 67.93 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.21 -42.0 56.5 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.608 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.08 -44.87 83.53 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.3 -38.93 71.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.93 -52.45 65.7 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -71.05 -26.77 63.22 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.447 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.0 t80 -62.08 -48.61 79.42 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -62.85 -38.15 89.66 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.46 -30.5 71.29 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.635 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.1 t80 -75.0 -49.07 21.07 Favored 'General case' 0 N--CA 1.433 -1.294 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.64 75.85 Favored 'General case' 0 CA--C 1.488 -1.407 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.1 t -63.35 -35.3 79.94 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 CA--C 1.513 -0.458 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.704 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 . . . . . 0 CA--C 1.501 -0.934 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.5 m -62.32 -40.63 96.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -30.95 66.53 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -66.57 -35.96 81.48 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -59.76 -35.49 74.71 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 74.6 m -62.08 -40.37 95.58 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -71.95 -38.69 69.75 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.92 -37.91 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.7 mtpt -64.85 -37.31 87.18 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.1 t60 -64.13 -41.91 97.02 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.462 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.7 m -60.27 -46.59 89.3 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.22 -33.61 70.04 Favored 'General case' 0 C--N 1.343 0.304 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 t -66.94 -37.82 85.02 Favored 'General case' 0 CA--C 1.483 -1.617 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.69 -39.32 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.758 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.462 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.0 m-20 -62.5 -32.48 73.4 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.9 m -93.93 -44.73 7.94 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.965 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.07 -40.27 62.22 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.52 69.99 9.61 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.723 0 C-N-CA 122.687 2.258 . . . . 0.0 112.389 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 . . . . . 0 N--CA 1.427 -1.577 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.4 -30.87 0.02 OUTLIER Glycine 0 C--N 1.343 0.944 0 N-CA-C 107.228 -2.349 . . . . 0.0 107.228 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.2 m -99.55 -33.33 10.69 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.29 -36.62 82.65 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.632 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.64 -26.1 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.69 -24.14 67.66 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.49 -41.89 54.3 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.39 -44.99 84.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -71.93 -38.49 69.85 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.43 -52.42 65.7 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.38 -26.65 62.88 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 -178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.615 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 55.4 t80 -63.05 -47.21 83.96 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.8 p -62.6 -38.14 89.0 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.79 -31.29 72.18 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.465 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.599 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.6 t80 -74.26 -47.28 36.11 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.615 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -58.13 -38.2 76.07 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -67.5 -27.57 67.1 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.508 -0.649 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.72 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 CA--C 1.503 -0.861 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m -61.95 -41.53 98.08 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -30.45 67.33 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.79 -37.72 87.04 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -60.41 -37.37 80.61 Favored 'General case' 0 CA--C 1.495 -1.162 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 70.1 m -63.06 -39.63 95.3 Favored 'General case' 0 CA--C 1.495 -1.168 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -70.95 -38.94 72.86 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.77 -38.27 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.6 mtpt -65.26 -37.77 88.24 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.599 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 73.2 t60 -63.84 -42.06 97.69 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.3 m -60.06 -46.18 90.42 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -71.01 -33.43 70.36 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.9 t -66.88 -38.09 85.64 Favored 'General case' 0 CA--C 1.482 -1.645 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.76 -39.52 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.81 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -179.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.7 m-20 -63.47 -31.5 72.68 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 85.3 m -91.9 -46.89 7.61 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.728 -0.789 . . . . 0.0 108.891 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.34 -40.27 60.76 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 70.19 11.57 Favored Pre-proline 0 C--N 1.351 0.643 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -177.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 C--O 1.263 1.774 0 C-N-CA 122.564 2.176 . . . . 0.0 112.373 179.487 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.427 -1.578 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.82 -30.27 0.02 OUTLIER Glycine 0 C--N 1.341 0.831 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.5 m -99.66 -33.51 10.58 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.1 -36.35 81.46 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.24 -25.4 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.77 -24.59 67.83 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.05 -42.06 57.83 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 179.481 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -57.22 -44.9 84.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.48 -38.55 71.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.71 -52.89 63.79 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.1 m -70.71 -27.7 64.18 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.502 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.4 t80 -61.42 -48.92 78.99 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.3 -37.36 86.95 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.452 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -64.76 -28.6 69.69 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.605 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.7 t80 -81.02 -47.24 13.87 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.0 mmmt -58.31 -30.31 66.57 Favored 'General case' 0 CA--C 1.48 -1.742 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.44 -35.29 71.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.7 m -62.56 -43.13 99.57 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.1 m -65.66 -38.18 88.6 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.506 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.6 t60 -64.44 -38.7 91.93 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -59.74 -39.79 85.92 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.02 -37.06 84.94 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.4 t60 -70.12 -37.92 75.45 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 35' ' ' HIS . 53.6 t -67.13 -37.39 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.7 mttt -64.42 -37.44 87.52 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 70.8 t60 -63.99 -42.31 97.25 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.472 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.7 m -60.0 -46.34 89.81 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -70.73 -33.45 70.86 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.54 -37.98 86.14 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.27 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.34 -39.28 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.816 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.472 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -63.24 -31.99 73.27 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.0 m -93.53 -44.95 7.97 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.887 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -39.97 63.02 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.609 -1.397 . . . . 0.0 109.609 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.01 69.71 9.94 Favored Pre-proline 0 C--N 1.351 0.645 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.996 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 C--O 1.26 1.609 0 C-N-CA 122.596 2.198 . . . . 0.0 112.436 179.539 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.426 -1.633 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.54 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.36 -2.296 . . . . 0.0 107.36 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.74 -33.55 10.54 Favored 'General case' 0 CA--C 1.49 -1.332 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.27 -36.79 83.16 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.643 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.1 p -69.81 -25.25 27.9 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.592 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.97 -24.62 67.79 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.22 -42.1 56.23 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 179.521 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.31 -44.96 84.61 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.1 t60 -71.1 -39.3 72.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.68 -52.19 66.72 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.7 m -71.1 -26.83 63.21 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.608 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 56.0 t80 -62.8 -47.03 85.2 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.7 p -62.83 -38.42 90.7 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.9 mptt -64.74 -31.65 72.98 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.622 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.8 t80 -73.93 -48.44 30.6 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.608 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.15 -37.76 72.53 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 t -64.55 -35.56 81.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t . . . . . 0 CA--C 1.514 -0.437 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.503 -0.85 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.0 m -62.1 -41.33 98.1 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.31 -30.26 67.2 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.74 -37.52 86.61 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -60.37 -37.41 80.67 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.8 m -63.03 -39.72 95.6 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -71.35 -38.51 71.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.54 -38.28 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.9 mtpt -65.05 -37.43 87.56 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.622 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 72.9 t60 -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.468 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.18 -45.98 91.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -70.45 -33.87 71.79 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.5 t -66.8 -38.69 86.99 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.12 -39.47 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.851 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.468 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.53 -30.62 71.71 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -92.45 -46.49 7.63 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 119.652 -0.819 . . . . 0.0 108.961 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.53 -39.75 55.64 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 69.85 11.5 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -177.646 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 C--O 1.263 1.736 0 C-N-CA 122.503 2.135 . . . . 0.0 112.328 179.537 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 N--CA 1.427 -1.597 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.94 0.02 OUTLIER Glycine 0 C--N 1.341 0.853 0 N-CA-C 107.312 -2.315 . . . . 0.0 107.312 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.3 m -99.76 -33.59 10.51 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.632 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.14 -36.51 82.03 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 179.671 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.53 -25.11 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.64 -24.57 67.84 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.26 -42.06 55.92 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.18 -44.83 83.93 Favored 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.69 -39.1 70.45 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -58.8 -52.18 66.8 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -70.92 -27.37 63.72 Favored 'General case' 0 CA--C 1.489 -1.395 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.622 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 53.1 t80 -62.54 -47.19 84.97 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.06 -38.05 89.65 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.22 -31.61 72.86 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.624 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.9 t80 -73.94 -47.85 34.68 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.32 -37.24 72.2 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -64.02 -36.78 85.1 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.1 t . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.506 -0.731 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.1 m -63.03 -41.69 99.58 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.8 m -67.7 -36.07 79.96 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.428 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.5 t60 -63.55 -36.42 83.74 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.74 -36.21 76.15 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 72.7 m -62.3 -39.96 94.71 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -72.17 -38.45 69.13 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -64.99 -38.11 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.997 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -64.72 -37.57 88.03 Favored 'General case' 0 CA--C 1.486 -1.485 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.624 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 75.9 t60 -64.31 -41.72 96.69 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.9 m -60.35 -46.47 89.83 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.02 -33.57 70.48 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.2 t -66.85 -37.94 85.41 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.41 -39.37 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.833 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.6 m-20 -62.59 -32.21 73.17 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -93.97 -44.84 7.87 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.621 -0.831 . . . . 0.0 108.997 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.09 -40.25 62.11 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.15 69.85 9.86 Favored Pre-proline 0 C--N 1.35 0.619 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -177.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 C--O 1.262 1.687 0 C-N-CA 122.686 2.258 . . . . 0.0 112.409 179.675 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 . . . . . 0 N--CA 1.432 -1.352 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.33 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 107.41 -2.276 . . . . 0.0 107.41 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.9 m -100.37 -34.37 9.99 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.626 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.42 -36.11 81.35 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.8 -25.22 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -63.46 -24.78 67.97 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.0 -42.22 57.9 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 25.9 mmt180 -57.11 -44.95 83.73 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -70.96 -38.46 72.8 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.7 -53.24 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.6 -27.62 64.23 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.732 -1.211 . . . . 0.0 107.732 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.503 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.7 t80 -61.46 -48.91 78.97 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.6 p -63.29 -37.34 86.86 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.02 -28.2 69.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.2 t80 -81.55 -46.78 13.96 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.503 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 22.3 mmmt -58.39 -30.51 66.88 Favored 'General case' 0 CA--C 1.478 -1.825 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.32 -35.03 71.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t . . . . . 0 CA--C 1.507 -0.692 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.996 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.9 m -62.36 -42.42 99.39 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -70.29 -32.15 69.8 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.514 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.7 t60 -65.29 -38.53 90.52 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -60.06 -39.28 85.45 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 55.9 m -66.22 -37.17 84.9 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.15 -38.04 75.37 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 35' ' ' HIS . 52.9 t -66.99 -37.54 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.4 mttt -64.58 -37.24 86.87 Favored 'General case' 0 CA--C 1.486 -1.491 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.586 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 71.3 t60 -63.9 -41.74 97.62 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.437 HG22 ' ND2' ' A' ' 46' ' ' ASN . 38.2 m -60.41 -46.38 90.22 Favored 'General case' 0 N--CA 1.436 -1.125 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.04 -33.34 70.21 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 31.5 t -66.38 -38.08 86.73 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.22 -39.37 35.19 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.941 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.437 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -63.49 -31.44 72.6 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.7 m -92.93 -45.4 7.98 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.868 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.28 -40.06 61.34 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.626 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -148.47 69.86 10.5 Favored Pre-proline 0 C--N 1.349 0.565 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.907 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.261 1.672 0 C-N-CA 122.67 2.246 . . . . 0.0 112.46 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.1 t70 . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.93 -30.98 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.34 -2.304 . . . . 0.0 107.34 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.9 m -99.51 -33.41 10.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.2 -36.34 81.64 Favored 'General case' 0 N--CA 1.428 -1.575 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 179.619 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.4 p -70.56 -25.09 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.587 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.59 -24.56 67.85 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.47 -42.15 53.85 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.556 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.42 -44.99 85.09 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.96 -39.22 72.69 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.99 -52.44 65.77 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.2 m -71.16 -26.65 63.07 Favored 'General case' 0 CA--C 1.49 -1.327 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.453 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.7 t80 -61.99 -48.67 79.29 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 65.4 p -62.83 -37.99 88.95 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.85 -30.53 71.16 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -74.86 -48.66 23.82 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.2 mmmt -58.97 -37.77 77.55 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.7 m -65.38 -28.56 69.35 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.8 t . . . . . 0 CA--C 1.508 -0.645 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.503 -0.841 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.8 m -62.97 -41.39 99.52 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.0 m -66.68 -36.26 82.1 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 39' ' ' VAL . 81.2 t60 -63.43 -37.26 86.59 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -59.93 -38.14 81.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 68.7 m -63.13 -39.62 95.22 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -70.49 -38.51 74.37 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.59 -37.65 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.75 -37.35 87.32 Favored 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.9 t60 -64.2 -42.1 96.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.1 m -60.19 -46.43 89.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.9 -34.03 71.16 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.75 -38.43 86.62 Favored 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -75.64 -39.36 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.763 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -63.28 -31.58 72.76 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -178.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.6 m -91.51 -47.17 7.57 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.904 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.27 -40.12 61.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.19 11.51 Favored Pre-proline 0 C--N 1.35 0.614 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -177.859 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.631 2.221 . . . . 0.0 112.383 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -159.29 -31.17 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 -179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 m -100.0 -34.41 10.1 Favored 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.86 -35.99 81.8 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.607 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.2 p -70.47 -24.68 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.51 -24.67 67.92 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.13 55.68 Favored 'General case' 0 CA--C 1.495 -1.146 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.44 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.26 -44.85 84.28 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -71.1 -38.99 72.35 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.96 -52.44 65.75 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.92 -26.87 63.39 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.0 -48.54 79.85 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.3 p -62.79 -37.96 88.77 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.89 -30.24 70.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.631 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.09 -48.66 22.76 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.68 -37.41 75.99 Favored 'General case' 0 CA--C 1.489 -1.382 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.4 m -64.85 -32.88 74.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.51 -0.56 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -179.766 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.504 -0.82 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.1 m -62.16 -41.04 97.91 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -70.28 -30.88 68.0 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.443 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.3 t60 -66.09 -36.9 84.4 Favored 'General case' 0 CA--C 1.501 -0.918 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -60.05 -36.99 78.52 Favored 'General case' 0 CA--C 1.495 -1.173 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 73.3 m -62.87 -39.84 95.66 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.6 t60 -71.13 -38.76 72.28 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.1 t -65.38 -37.98 81.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.077 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -65.05 -37.17 86.71 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.631 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.5 t60 -64.02 -41.82 97.31 Favored 'General case' 0 CA--C 1.497 -1.063 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.3 m -60.31 -46.31 90.34 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.13 -33.89 70.52 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.61 -37.98 86.0 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -76.28 -39.24 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.455 ' ND2' HG22 ' A' ' 42' ' ' THR . 60.0 m-20 -62.57 -32.18 73.11 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.3 m -94.05 -44.71 7.91 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.88 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.93 -40.26 63.32 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.36 69.72 9.67 Favored Pre-proline 0 C--N 1.349 0.583 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.955 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.638 2.225 . . . . 0.0 112.414 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 N--CA 1.433 -1.306 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.66 -31.53 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 107.414 -2.274 . . . . 0.0 107.414 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -100.2 -34.7 9.91 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.66 -36.42 82.8 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -70.29 -25.35 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.54 -24.44 67.81 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.2 -42.3 55.93 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.554 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.17 -44.86 83.9 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.88 -39.31 72.9 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -58.92 -52.24 66.59 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.2 m -70.97 -26.85 63.33 Favored 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.469 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -62.14 -48.44 80.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 72.4 p -62.72 -38.27 89.83 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.28 -31.28 72.34 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 179.597 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.644 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.5 t80 -73.99 -49.16 25.68 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.469 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.4 mmmt -58.07 -37.16 73.94 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.3 t -63.48 -37.11 86.03 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.9 t . . . . . 0 C--N 1.348 0.526 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 . . . . . 0 CA--C 1.507 -0.684 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.6 m -62.52 -42.5 99.55 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 86.6 m -67.29 -36.36 81.38 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.7 t60 -63.27 -36.33 83.3 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.58 -36.19 75.75 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 69.8 m -62.29 -40.08 95.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -71.6 -38.84 70.82 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -65.3 -37.57 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -64.45 -37.62 88.16 Favored 'General case' 0 CA--C 1.486 -1.482 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.7 t60 -64.2 -42.2 96.75 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.8 m -60.22 -46.54 89.39 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -70.92 -33.86 70.95 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.7 t -66.99 -37.99 85.22 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.03 -39.48 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.844 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.2 m-20 -62.79 -31.84 72.89 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.594 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.6 m -93.6 -45.36 7.76 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.672 -0.811 . . . . 0.0 108.949 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.12 -40.25 61.93 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.643 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -148.96 69.17 9.87 Favored Pre-proline 0 C--N 1.349 0.567 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.882 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo . . . . . 0 C--O 1.261 1.644 0 C-N-CA 122.858 2.372 . . . . 0.0 112.698 179.587 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 . . . . . 0 N--CA 1.426 -1.647 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.65 -30.63 0.02 OUTLIER Glycine 0 C--N 1.341 0.825 0 N-CA-C 107.295 -2.322 . . . . 0.0 107.295 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 m -99.77 -33.58 10.52 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.62 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.61 82.33 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.632 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.556 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.59 -25.55 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -63.72 -24.34 67.73 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.21 -41.87 56.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.05 -44.82 83.36 Favored 'General case' 0 N--CA 1.428 -1.544 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.45 -38.78 71.28 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.02 -52.4 65.94 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.0 m -70.77 -27.09 63.67 Favored 'General case' 0 CA--C 1.49 -1.359 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.44 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.1 t80 -61.8 -48.73 79.31 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.3 p -62.76 -38.04 89.0 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.443 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.25 -31.09 72.06 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.8 t80 -74.42 -48.74 25.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.4 mmmt -58.4 -36.46 73.6 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.1 m -64.12 -34.74 78.75 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.8 t . . . . . 0 C--N 1.349 0.562 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.501 -0.906 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -61.73 -41.12 97.23 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -33.47 72.98 Favored 'General case' 0 C--N 1.352 0.692 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.431 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.0 t60 -65.34 -37.2 86.35 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -60.14 -36.35 77.32 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.2 m -62.24 -40.18 95.31 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -71.62 -39.12 70.67 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.09 -37.45 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.62 -37.61 88.15 Favored 'General case' 0 CA--C 1.486 -1.488 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 78.2 t60 -64.55 -41.85 96.08 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.8 m -60.31 -46.81 88.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.41 -33.21 69.24 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 t -67.14 -37.84 84.51 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.0 t -76.69 -39.5 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -62.61 -32.37 73.38 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.9 m -94.11 -44.63 7.92 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 119.628 -0.829 . . . . 0.0 108.861 -178.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.88 -40.37 63.8 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.62 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.76 69.95 9.41 Favored Pre-proline 0 C--N 1.35 0.589 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.992 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.712 0 C-N-CA 122.648 2.232 . . . . 0.0 112.444 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.427 -1.576 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.85 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.864 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.5 m -99.62 -33.61 10.55 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.629 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.19 -36.69 82.65 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.7 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.559 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.37 -25.14 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.97 -24.27 67.66 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.48 -42.17 53.63 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.471 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -57.38 -44.81 84.75 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -71.31 -39.72 71.26 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.91 -51.81 68.43 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.2 m -70.15 -29.79 66.78 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.493 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 41.5 t80 -61.42 -49.29 77.46 Favored 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 61.9 p -63.44 -38.24 90.37 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -63.45 -29.31 70.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.591 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.6 t80 -80.38 -47.38 14.51 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.4 mmmt -58.02 -30.57 66.22 Favored 'General case' 0 CA--C 1.48 -1.731 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.7 t -58.45 -35.4 72.06 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 40.1 t . . . . . 0 CA--C 1.505 -0.75 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.995 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 . . . . . 0 CA--C 1.508 -0.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.2 m -62.43 -43.15 99.5 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.3 -38.57 90.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.504 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.0 t60 -64.82 -38.97 92.77 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -59.73 -39.4 84.61 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 56.2 m -65.98 -37.21 85.38 Favored 'General case' 0 CA--C 1.498 -1.058 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -70.5 -37.92 74.23 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 35' ' ' HIS . 54.8 t -67.25 -37.27 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 44' ' ' CYS . 9.8 mttt -64.07 -37.4 87.31 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.591 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 71.5 t60 -64.04 -42.55 97.04 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.476 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.7 m -60.06 -46.57 89.12 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -70.8 -33.1 70.37 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' LYS . 34.0 t -66.49 -37.89 86.06 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -76.82 -39.62 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.921 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.476 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.01 -32.73 74.16 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -93.78 -44.56 8.07 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.907 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.01 -40.19 62.62 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.629 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.23 69.7 9.77 Favored Pre-proline 0 C--N 1.35 0.597 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.957 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.261 1.652 0 C-N-CA 122.665 2.244 . . . . 0.0 112.432 179.59 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.426 -1.628 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.29 0.02 OUTLIER Glycine 0 C--N 1.342 0.901 0 N-CA-C 107.313 -2.315 . . . . 0.0 107.313 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -99.9 -33.43 10.53 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.13 -36.27 81.27 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.599 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.553 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.32 -25.01 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.62 -24.67 67.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.16 -42.07 56.8 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.594 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.1 -44.97 83.71 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.17 -39.01 72.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -58.98 -52.34 66.16 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 88.7 m -71.09 -27.2 63.44 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.452 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -61.94 -48.5 80.11 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.1 p -62.63 -38.12 89.01 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 -179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.11 -31.78 73.16 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 7.0 t80 -73.81 -49.21 26.34 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.23 -36.7 73.55 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.5 t -62.23 -36.42 81.94 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 11.3 t . . . . . 0 CA--C 1.511 -0.548 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.509 -0.626 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -63.25 -41.75 99.1 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.9 m -67.09 -36.14 81.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 39' ' ' VAL . 78.4 t60 -63.53 -37.12 86.11 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -59.82 -35.16 74.14 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -179.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 84.7 m -62.46 -39.97 95.12 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.9 t60 -73.75 -36.53 65.13 Favored 'General case' 0 CA--C 1.498 -1.031 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 35' ' ' HIS . 51.1 t -65.82 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.02 -28.02 65.15 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 -179.376 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 73.2 t60 -70.75 -40.45 72.7 Favored 'General case' 0 CA--C 1.49 -1.364 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.452 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.2 m -61.18 -46.16 91.66 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.61 -33.55 69.08 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.3 t -66.52 -37.99 86.22 Favored 'General case' 0 CA--C 1.481 -1.674 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.53 -39.39 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.83 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.452 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.6 m-20 -62.72 -32.26 73.33 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.4 m -94.03 -44.69 7.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.599 -0.841 . . . . 0.0 108.901 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.2 63.06 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -178.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.69 69.95 9.47 Favored Pre-proline 0 C--N 1.35 0.6 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -177.975 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.263 1.743 0 C-N-CA 122.636 2.224 . . . . 0.0 112.416 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.97 0.414 . . . . 0.0 110.162 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 98.3 p -155.59 163.18 40.29 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 55.3 p -75.96 150.98 83.99 Favored Pre-proline 0 N--CA 1.431 -1.402 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.88 -61.51 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.333 0 C-N-CA 122.418 2.079 . . . . 0.0 112.415 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -161.88 -134.94 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 107.192 -1.411 . . . . 0.0 107.192 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.11 -31.27 0.02 OUTLIER Glycine 0 C--N 1.343 0.921 0 N-CA-C 107.366 -2.294 . . . . 0.0 107.366 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.75 -33.74 10.46 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.637 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.66 82.19 Favored 'General case' 0 N--CA 1.428 -1.54 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.562 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.52 -25.91 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.53 -24.66 67.9 Favored 'General case' 0 CA--C 1.504 -0.821 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.14 -42.31 56.49 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.4 -45.06 84.94 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -70.86 -39.31 72.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.1 t70 -59.17 -52.06 67.31 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.9 m -70.94 -26.9 63.38 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.02 -48.37 80.57 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.3 p -62.44 -38.76 91.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.4 mptt -65.14 -31.14 72.18 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.1 t80 -74.3 -49.23 23.86 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.92 76.41 Favored 'General case' 0 CA--C 1.487 -1.448 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.6 t -62.77 -34.51 77.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.3 t -67.62 -38.35 83.79 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -69.88 -25.39 63.68 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.2 mmt -81.19 -19.11 44.02 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -70.36 163.64 26.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -81.97 7.71 12.41 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.5 m -78.59 -14.78 59.16 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.7 t -89.18 67.84 8.03 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -105.78 -30.11 9.62 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.47 163.77 15.56 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -70.69 -40.5 72.88 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -68.69 -40.98 79.8 Favored 'General case' 0 CA--C 1.5 -0.962 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.6 m -62.05 -40.67 96.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.92 -30.42 63.89 Favored 'General case' 0 C--N 1.349 0.578 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.422 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -65.54 -36.48 83.93 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.86 -36.41 76.8 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 82.5 m -62.42 -40.0 95.12 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -71.38 -38.95 71.5 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.37 -37.57 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttm -64.65 -37.5 87.79 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.8 t60 -64.48 -42.04 96.13 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.1 m -60.55 -46.48 90.02 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -71.07 -33.69 70.47 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.3 t -66.92 -38.5 86.32 Favored 'General case' 0 CA--C 1.48 -1.729 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.88 -39.46 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.481 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.92 -32.23 73.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.0 m -91.71 -46.94 7.64 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.916 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.92 -40.4 63.28 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.637 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.06 11.48 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -177.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 C--O 1.262 1.713 0 C-N-CA 122.616 2.211 . . . . 0.0 112.393 179.48 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.034 0.445 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.0 t -151.76 146.84 26.03 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 32.9 m -78.63 130.47 70.85 Favored Pre-proline 0 N--CA 1.437 -1.097 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.561 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 66.3 Cg_exo -52.32 -42.7 58.84 Favored 'Trans proline' 0 CA--C 1.498 -1.309 0 C-N-CA 122.622 2.214 . . . . 0.0 112.847 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -155.08 -133.85 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.67 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.36 -34.45 9.96 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.639 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.3 -36.32 81.76 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.613 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -70.49 -24.84 25.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -179.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.78 -24.35 67.73 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.37 -42.07 54.88 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.32 -44.85 84.54 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -71.05 -39.16 72.43 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.0 -52.31 66.3 Favored 'General case' 0 C--O 1.219 -0.515 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.1 m -70.97 -27.0 63.41 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.46 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.1 t80 -61.98 -48.6 79.61 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.78 -37.91 88.51 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.53 -31.15 72.06 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.642 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.32 -48.65 26.94 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.27 -37.08 74.27 Favored 'General case' 0 CA--C 1.488 -1.423 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -63.22 -34.54 77.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t -69.28 -37.14 77.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -69.28 -23.93 63.9 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.8 mmt -84.9 -16.35 41.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.8 m -68.12 160.13 29.59 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.21 1.84 23.22 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -80.93 -10.56 59.7 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.7 t -91.84 70.32 5.6 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.7 p80 -115.43 -34.03 5.07 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -105.36 151.1 24.61 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.93 -39.16 93.52 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.46 -44.2 79.21 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.7 m -63.14 -41.66 99.34 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.6 m -67.36 -36.03 80.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.3 t60 -63.47 -36.18 82.89 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -59.62 -36.75 76.93 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.3 m -62.23 -39.98 94.63 Favored 'General case' 0 CA--C 1.496 -1.11 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -71.44 -38.62 71.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.07 -37.52 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.989 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -64.76 -37.32 87.21 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.642 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.3 t60 -64.23 -41.89 96.81 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.461 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.8 m -60.24 -46.33 90.16 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.98 -33.93 70.9 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.93 -37.9 85.18 Favored 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.29 -39.3 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.461 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.0 m-20 -62.5 -32.36 73.27 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -94.07 -44.68 7.91 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.896 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.27 63.5 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.639 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.48 69.85 9.61 Favored Pre-proline 0 C--N 1.349 0.581 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 -177.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.677 2.252 . . . . 0.0 112.444 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.02 0.438 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.8 t -152.3 146.93 25.78 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.6 m -78.05 130.69 71.84 Favored Pre-proline 0 N--CA 1.437 -1.077 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.556 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 59.7 Cg_exo -52.33 -43.03 56.92 Favored 'Trans proline' 0 CA--C 1.497 -1.362 0 C-N-CA 122.645 2.23 . . . . 0.0 112.762 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -156.17 -133.38 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.66 -31.56 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 N-CA-C 107.305 -2.318 . . . . 0.0 107.305 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.0 m -100.39 -34.24 10.04 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.36 -36.21 81.52 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.63 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.547 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.69 -24.82 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.548 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.52 -24.66 67.91 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.06 55.82 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.24 -44.85 84.22 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -71.04 -39.11 72.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.96 -52.48 65.57 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.7 m -70.94 -26.89 63.38 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.03 -48.54 79.79 Favored 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.2 p -62.94 -38.08 89.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.68 -30.25 70.91 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.633 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -75.16 -49.09 20.62 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.29 -37.99 76.11 Favored 'General case' 0 CA--C 1.49 -1.356 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.9 t -63.66 -35.32 80.16 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 16.6 t -66.62 -38.94 88.0 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -70.34 -22.45 62.8 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 34.9 mmt -85.54 -15.85 41.37 Favored 'General case' 0 CA--C 1.491 -1.325 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.0 m -70.45 162.05 29.42 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -87.9 13.69 10.36 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.0 m -81.56 -8.48 59.72 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.2 t -86.76 78.8 9.02 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -87.01 -28.24 22.75 Favored 'General case' 0 CA--C 1.5 -0.972 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.8 t0 -139.93 175.09 9.88 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.52 -37.63 85.43 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -63.23 -40.85 98.63 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.427 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 71.1 m -62.23 -41.25 98.23 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -30.87 68.28 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.453 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -66.07 -37.14 85.08 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -60.29 -37.15 79.59 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.5 m -62.9 -39.89 95.89 Favored 'General case' 0 CA--C 1.497 -1.068 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -71.03 -38.79 72.58 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.3 t -65.18 -37.92 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -65.11 -37.16 86.57 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.633 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.0 t60 -64.03 -41.66 97.34 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.453 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.16 -46.56 89.27 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.29 -33.68 69.95 Favored 'General case' 0 C--N 1.344 0.349 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.0 t -66.8 -37.88 85.41 Favored 'General case' 0 CA--C 1.482 -1.653 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.5 -39.32 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.799 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.453 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.4 m-20 -62.64 -32.29 73.3 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.0 m -94.02 -44.61 7.97 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 119.643 -0.823 . . . . 0.0 108.923 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.34 62.97 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -178.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.59 69.97 9.55 Favored Pre-proline 0 C--N 1.349 0.571 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -177.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.262 1.692 0 C-N-CA 122.646 2.231 . . . . 0.0 112.393 179.672 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 121.087 0.47 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.9 t -152.94 145.81 24.46 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -78.76 129.51 73.54 Favored Pre-proline 0 N--CA 1.439 -1.013 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -64.47 -62.55 0.09 OUTLIER 'Trans proline' 0 CA--C 1.498 -1.314 0 C-N-CA 122.322 2.015 . . . . 0.0 112.498 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 -162.82 -133.85 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.583 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.48 -30.4 0.02 OUTLIER Glycine 0 C--N 1.341 0.844 0 N-CA-C 107.309 -2.317 . . . . 0.0 107.309 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.4 m -99.74 -33.35 10.62 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -69.94 -25.23 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -24.17 67.61 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.44 -41.64 55.35 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -57.35 -44.89 84.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -71.22 -38.95 71.98 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 21.8 t70 -58.97 -52.41 65.87 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.1 m -70.84 -26.78 63.43 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.06 -48.44 80.24 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.72 -38.7 91.51 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -64.85 -31.16 72.26 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.4 t80 -74.03 -49.67 23.19 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.8 mmmt -58.29 -37.83 75.81 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.3 t -63.37 -34.85 78.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.1 t -66.55 -39.4 88.52 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -70.49 -23.19 62.63 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 34.6 mmt -83.79 -17.49 40.93 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.0 m -71.45 163.2 28.15 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -88.23 13.68 10.97 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -80.14 -9.06 59.69 Favored 'General case' 0 CA--C 1.486 -1.499 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.3 t -87.19 78.95 8.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -87.19 -30.18 21.19 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.462 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.2 t0 -138.32 175.9 9.17 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.47 -38.26 86.92 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.74 -40.64 97.23 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.462 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.2 m -61.97 -41.29 97.85 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -31.22 68.5 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.458 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.5 t60 -65.78 -37.4 86.2 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -60.21 -36.99 78.91 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 82.6 m -62.84 -39.97 96.01 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -71.2 -38.67 72.07 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.32 -38.04 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.5 mtpt -64.81 -37.37 87.4 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.6 t60 -63.85 -42.14 97.64 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.8 m -60.18 -46.14 90.71 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.03 -33.73 70.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.1 t -66.94 -37.94 85.24 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.33 -39.22 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.828 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.6 m-20 -62.53 -32.51 73.46 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -94.25 -44.4 7.98 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 119.549 -0.86 . . . . 0.0 108.885 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -40.16 62.76 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.64 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.62 69.74 9.48 Favored Pre-proline 0 C--N 1.35 0.593 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 -177.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.652 2.234 . . . . 0.0 112.398 179.646 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 120.977 0.418 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.8 m -131.19 148.61 52.73 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 32.3 m -79.16 130.57 68.91 Favored Pre-proline 0 N--CA 1.437 -1.084 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.561 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 65.4 Cg_exo -52.07 -42.71 57.41 Favored 'Trans proline' 0 CA--C 1.497 -1.337 0 C-N-CA 122.513 2.142 . . . . 0.0 112.795 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -155.81 -133.0 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.31 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.68 -31.6 0.02 OUTLIER Glycine 0 CA--C 1.501 -0.819 0 N-CA-C 107.38 -2.288 . . . . 0.0 107.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.0 m -100.58 -34.33 9.94 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.633 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.09 -36.79 82.75 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.636 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -69.97 -24.94 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -63.94 -24.7 67.83 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.24 -41.93 56.39 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.03 -45.03 83.45 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -70.9 -39.0 73.01 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -58.71 -52.62 64.93 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.1 -26.72 63.16 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.6 t80 -62.21 -48.61 79.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 67.4 p -62.74 -38.17 89.45 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.95 -29.95 70.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.626 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.36 -48.66 21.96 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.8 -38.0 77.62 Favored 'General case' 0 CA--C 1.491 -1.323 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 73.6 m -65.71 -28.09 68.81 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 14.3 t -71.35 -39.27 71.41 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -70.53 -22.83 62.58 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.5 mmt -83.46 -17.52 41.76 Favored 'General case' 0 CA--C 1.492 -1.28 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.1 m -70.58 162.79 28.24 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -88.0 13.41 11.09 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -81.45 -8.81 59.78 Favored 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.1 t -87.78 79.29 8.2 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -86.92 -29.61 21.97 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.9 t0 -139.32 175.98 9.1 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.32 -38.03 86.73 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.37 -40.69 97.94 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.443 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.7 m -62.1 -41.44 98.21 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -30.39 67.27 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.461 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -65.83 -37.47 86.32 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -60.36 -37.12 79.72 Favored 'General case' 0 CA--C 1.494 -1.175 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.2 m -63.07 -39.77 95.69 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.93 -38.81 72.92 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.7 t -65.35 -38.16 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -64.94 -37.34 87.33 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.4 t60 -63.78 -41.97 97.84 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.477 HG22 ' ND2' ' A' ' 46' ' ' ASN . 33.1 m -60.13 -46.14 90.66 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.16 -33.66 70.23 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.8 t -66.86 -37.94 85.39 Favored 'General case' 0 CA--C 1.482 -1.664 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.47 -39.32 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.883 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.477 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.1 m-20 -62.36 -32.44 73.23 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.3 m -94.32 -44.43 7.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.914 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.85 -40.37 64.07 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.633 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.71 69.73 9.41 Favored Pre-proline 0 C--N 1.349 0.568 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 -177.933 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.264 1.777 0 C-N-CA 122.654 2.236 . . . . 0.0 112.389 179.59 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.031 0.443 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -132.31 148.42 52.43 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.8 m -79.54 129.12 72.69 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -63.84 -62.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.384 2.056 . . . . 0.0 112.493 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.7 t70 -162.46 -133.75 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.66 -30.3 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 N-CA-C 107.314 -2.314 . . . . 0.0 107.314 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.4 m -99.73 -33.44 10.58 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.08 -36.53 81.95 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.05 -25.2 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.9 -24.38 67.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.3 -41.92 55.84 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -57.23 -44.87 84.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.28 -39.08 71.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.3 t70 -58.75 -52.65 64.78 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -70.7 -27.05 63.7 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.432 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 46.8 t80 -62.01 -48.63 79.42 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.0 p -62.99 -38.32 90.7 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -65.52 -30.08 70.8 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.1 t80 -75.42 -49.19 19.68 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.3 mmmt -58.54 -38.66 78.26 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -67.4 -27.31 66.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.8 t -71.02 -40.53 71.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -71.14 -22.9 62.01 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.3 mmt -83.23 -17.0 44.24 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.0 m -70.91 163.97 26.36 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -86.74 12.74 10.1 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.6 m -80.99 -8.98 59.89 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.0 t -87.87 79.47 8.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -85.52 -28.61 24.83 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' H ' ' HB2' ' A' ' 33' ' ' SER . 2.2 t0 -140.99 175.95 9.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -65.93 -37.98 87.46 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -63.04 -40.73 98.59 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.6 m -61.98 -41.5 98.09 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.96 -31.23 68.85 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.438 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.1 t60 -65.8 -37.51 86.46 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.12 -37.23 79.42 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 71.8 m -62.65 -39.71 94.73 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -70.87 -38.92 73.11 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.76 -38.06 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -65.39 -37.0 85.67 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 75.9 t60 -63.68 -42.05 98.08 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.466 HG22 ' ND2' ' A' ' 46' ' ' ASN . 35.7 m -60.03 -46.25 90.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.36 -33.33 69.47 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 t -66.83 -37.9 85.4 Favored 'General case' 0 CA--C 1.48 -1.719 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.71 -39.46 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.871 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.466 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.56 -32.57 73.56 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -178.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -94.01 -44.35 8.09 Favored 'General case' 0 CA--C 1.509 -0.614 0 C-N-CA 119.65 -0.82 . . . . 0.0 108.938 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.1 -40.12 62.23 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.85 69.82 9.32 Favored Pre-proline 0 C--N 1.349 0.58 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -177.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 C--O 1.262 1.718 0 C-N-CA 122.546 2.164 . . . . 0.0 112.48 179.535 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 121.023 0.439 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -152.98 145.09 23.82 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.5 m -79.33 129.61 71.6 Favored Pre-proline 0 N--CA 1.439 -1.012 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -63.0 -62.17 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.343 2.029 . . . . 0.0 112.441 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 -161.93 -133.56 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.99 -30.69 0.02 OUTLIER Glycine 0 C--N 1.342 0.885 0 N-CA-C 107.354 -2.298 . . . . 0.0 107.354 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 m -99.63 -33.42 10.63 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.64 82.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.22 -25.27 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -24.14 67.65 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.6 -41.72 53.76 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.27 -44.9 84.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.59 -38.83 70.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.98 -52.41 65.89 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.7 m -70.74 -27.11 63.71 Favored 'General case' 0 CA--C 1.49 -1.337 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.423 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.5 t80 -61.85 -48.6 79.82 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.2 p -62.87 -38.4 90.72 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.12 -30.82 71.79 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.645 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.4 -49.52 22.26 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.3 mmmt -58.16 -37.95 75.67 Favored 'General case' 0 CA--C 1.491 -1.321 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.2 t -64.1 -34.98 79.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 18.1 t -66.6 -39.22 88.28 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.97 -23.12 63.12 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.9 mmt -86.08 -16.13 39.05 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -70.94 162.68 28.94 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -87.98 13.96 9.95 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.6 m -80.55 -8.83 59.73 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -87.01 78.71 8.92 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.61 -28.65 23.12 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.424 ' H ' ' HB2' ' A' ' 33' ' ' SER . 5.1 t0 -140.06 175.3 9.7 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.52 -37.64 85.46 Favored 'General case' 0 CA--C 1.505 -0.778 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 73.3 tp60 -63.0 -41.66 99.65 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.424 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.5 m -62.9 -40.69 98.34 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.14 -32.64 72.14 Favored 'General case' 0 C--N 1.351 0.66 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.423 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -66.06 -36.91 84.47 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -60.03 -36.31 77.0 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.7 m -62.71 -39.99 95.76 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -71.46 -38.87 71.26 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.55 -37.63 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -64.78 -37.16 86.67 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.8 t60 -64.0 -42.16 97.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.456 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.9 m -60.03 -46.48 89.37 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.27 -33.39 69.72 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.7 t -66.97 -37.84 84.99 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.52 -39.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.826 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.456 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -62.55 -32.64 73.63 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.8 m -94.24 -44.37 8.0 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.961 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.9 -40.27 63.6 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.7 69.7 9.41 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.261 1.673 0 C-N-CA 122.674 2.249 . . . . 0.0 112.462 179.665 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.989 0.424 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 t -151.87 146.31 25.57 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.6 m -79.06 129.99 71.14 Favored Pre-proline 0 N--CA 1.436 -1.134 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.562 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 66.0 Cg_exo -52.2 -42.56 59.04 Favored 'Trans proline' 0 CA--C 1.498 -1.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.857 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -154.97 -133.88 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.6 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 107.369 -2.293 . . . . 0.0 107.369 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.25 -34.45 10.0 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.32 -36.48 82.31 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 179.584 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.549 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.41 -24.89 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.48 -24.94 68.04 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -74.99 -41.98 58.44 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -57.26 -44.93 84.37 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -70.94 -38.88 72.87 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.91 -52.61 64.99 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.2 m -70.77 -27.17 63.73 Favored 'General case' 0 CA--C 1.49 -1.336 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.45 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.4 t80 -61.88 -48.67 79.45 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.7 p -62.77 -37.89 88.43 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.49 -31.24 72.21 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.9 t80 -74.62 -48.33 27.08 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.7 mmmt -58.76 -37.58 76.56 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -65.11 -28.24 69.3 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 9.5 t -71.54 -38.54 71.02 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -70.69 -23.5 62.49 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.0 mmt -81.76 -17.57 47.24 Favored 'General case' 0 CA--C 1.49 -1.353 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.8 m -69.72 163.78 24.93 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -84.11 7.21 19.52 Favored 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -81.2 -10.8 59.56 Favored 'General case' 0 CA--C 1.495 -1.154 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.32 71.64 8.15 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -109.44 -33.99 6.66 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -111.06 153.02 26.23 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.703 -1.591 . . . . 0.0 106.703 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.35 -39.44 92.36 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.34 -42.42 83.56 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.5 t -62.76 -42.58 99.75 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.23 -30.09 68.17 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -65.72 -35.46 80.8 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.03 -35.24 74.67 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 76.5 m -62.31 -40.22 95.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -71.55 -38.82 70.96 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.17 -37.85 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 1.4 mtpp -65.08 -37.11 86.45 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.5 t60 -64.09 -41.65 97.22 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.457 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.8 m -60.28 -46.49 89.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.26 -33.53 69.88 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.3 t -66.76 -37.86 85.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.58 -39.27 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.872 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.457 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.5 m-20 -62.64 -32.31 73.33 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -93.9 -44.71 7.96 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.869 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.26 63.56 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.62 69.93 9.52 Favored Pre-proline 0 C--N 1.349 0.564 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.263 1.731 0 C-N-CA 122.685 2.256 . . . . 0.0 112.439 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 120.97 0.414 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -153.46 146.07 24.19 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.2 m -78.73 129.13 74.85 Favored Pre-proline 0 N--CA 1.438 -1.039 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.03 -62.86 0.09 OUTLIER 'Trans proline' 0 CA--C 1.496 -1.384 0 C-N-CA 122.312 2.008 . . . . 0.0 112.514 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 -162.4 -133.76 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.87 -30.32 0.02 OUTLIER Glycine 0 C--N 1.341 0.837 0 N-CA-C 107.335 -2.306 . . . . 0.0 107.335 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.8 m -99.86 -33.31 10.6 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.04 -36.36 81.37 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.548 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.43 -24.96 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.52 -24.7 67.93 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.21 -42.0 56.5 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.608 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.08 -44.87 83.53 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.3 -38.93 71.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.93 -52.45 65.7 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -71.05 -26.77 63.22 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.447 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.0 t80 -62.08 -48.61 79.42 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -62.85 -38.15 89.66 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.46 -30.5 71.29 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.635 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.1 t80 -75.0 -49.07 21.07 Favored 'General case' 0 N--CA 1.433 -1.294 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.64 75.85 Favored 'General case' 0 CA--C 1.488 -1.407 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.1 t -63.35 -35.3 79.94 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.5 t -66.39 -38.81 88.36 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -70.45 -23.08 62.64 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.4 mmt -83.76 -16.9 43.01 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -70.38 163.42 26.68 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -83.76 9.17 12.49 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.6 m -80.21 -11.91 59.69 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.1 t -88.05 68.14 9.09 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -102.78 -29.12 11.67 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.6 163.47 16.76 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -70.68 -39.85 73.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -67.38 -41.27 85.31 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.5 m -62.32 -40.63 96.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -30.95 66.53 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -66.57 -35.96 81.48 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -59.76 -35.49 74.71 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 74.6 m -62.08 -40.37 95.58 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -71.95 -38.69 69.75 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.92 -37.91 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.7 mtpt -64.85 -37.31 87.18 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.1 t60 -64.13 -41.91 97.02 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.462 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.7 m -60.27 -46.59 89.3 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.22 -33.61 70.04 Favored 'General case' 0 C--N 1.343 0.304 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 t -66.94 -37.82 85.02 Favored 'General case' 0 CA--C 1.483 -1.617 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.69 -39.32 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.758 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.462 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.0 m-20 -62.5 -32.48 73.4 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.9 m -93.93 -44.73 7.94 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.965 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.07 -40.27 62.22 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.52 69.99 9.61 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.723 0 C-N-CA 122.687 2.258 . . . . 0.0 112.389 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 121.048 0.452 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -153.02 145.42 24.06 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.1 m -78.46 128.77 76.71 Favored Pre-proline 0 N--CA 1.437 -1.079 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.94 -62.0 0.11 Allowed 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.296 1.997 . . . . 0.0 112.559 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 -162.47 -133.79 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.577 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.4 -30.87 0.02 OUTLIER Glycine 0 C--N 1.343 0.944 0 N-CA-C 107.228 -2.349 . . . . 0.0 107.228 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.2 m -99.55 -33.33 10.69 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.29 -36.62 82.65 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.632 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.64 -26.1 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.69 -24.14 67.66 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.49 -41.89 54.3 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.39 -44.99 84.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -71.93 -38.49 69.85 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.43 -52.42 65.7 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.38 -26.65 62.88 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 -178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.615 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 55.4 t80 -63.05 -47.21 83.96 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.8 p -62.6 -38.14 89.0 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.79 -31.29 72.18 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.465 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.599 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.6 t80 -74.26 -47.28 36.11 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.615 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -58.13 -38.2 76.07 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -67.5 -27.57 67.1 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.2 -38.78 72.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -71.23 -22.93 61.93 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.5 mmt -82.8 -17.74 42.99 Favored 'General case' 0 CA--C 1.493 -1.221 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -70.47 161.35 30.73 Favored 'General case' 0 CA--C 1.502 -0.904 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -88.79 13.24 12.96 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 m -81.72 -8.91 59.75 Favored 'General case' 0 CA--C 1.488 -1.427 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 t -87.17 79.13 8.7 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -86.77 -28.73 22.82 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -138.93 175.28 9.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.75 -37.39 84.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -63.02 -41.0 99.44 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m -61.95 -41.53 98.08 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -30.45 67.33 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.79 -37.72 87.04 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -60.41 -37.37 80.61 Favored 'General case' 0 CA--C 1.495 -1.162 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 70.1 m -63.06 -39.63 95.3 Favored 'General case' 0 CA--C 1.495 -1.168 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -70.95 -38.94 72.86 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.77 -38.27 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.6 mtpt -65.26 -37.77 88.24 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.599 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 73.2 t60 -63.84 -42.06 97.69 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.3 m -60.06 -46.18 90.42 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -71.01 -33.43 70.36 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.9 t -66.88 -38.09 85.64 Favored 'General case' 0 CA--C 1.482 -1.645 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.76 -39.52 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.81 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -179.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.7 m-20 -63.47 -31.5 72.68 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 85.3 m -91.9 -46.89 7.61 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.728 -0.789 . . . . 0.0 108.891 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.34 -40.27 60.76 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 70.19 11.57 Favored Pre-proline 0 C--N 1.351 0.643 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -177.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 C--O 1.263 1.774 0 C-N-CA 122.564 2.176 . . . . 0.0 112.373 179.487 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 121.082 0.467 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m -131.91 148.02 52.51 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.8 m -79.57 129.49 71.3 Favored Pre-proline 0 N--CA 1.44 -0.945 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.02 -62.61 0.09 OUTLIER 'Trans proline' 0 CA--C 1.498 -1.302 0 C-N-CA 122.415 2.077 . . . . 0.0 112.416 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -162.78 -133.7 0.02 OUTLIER 'General case' 0 N--CA 1.427 -1.578 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.82 -30.27 0.02 OUTLIER Glycine 0 C--N 1.341 0.831 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.5 m -99.66 -33.51 10.58 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.1 -36.35 81.46 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.24 -25.4 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.77 -24.59 67.83 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.05 -42.06 57.83 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 179.481 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -57.22 -44.9 84.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.48 -38.55 71.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.71 -52.89 63.79 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.1 m -70.71 -27.7 64.18 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.502 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.4 t80 -61.42 -48.92 78.99 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.3 -37.36 86.95 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.452 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -64.76 -28.6 69.69 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.605 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.7 t80 -81.02 -47.24 13.87 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.0 mmmt -58.31 -30.31 66.57 Favored 'General case' 0 CA--C 1.48 -1.742 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.44 -35.29 71.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.0 t -69.57 -42.06 75.01 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -64.74 -25.19 67.82 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.5 mmt -84.86 -21.07 29.92 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.7 m -77.5 167.3 21.86 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -87.9 6.48 35.41 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.0 m -80.76 -12.23 59.49 Favored 'General case' 0 CA--C 1.494 -1.193 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.8 t -93.46 66.81 3.94 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -111.47 -32.78 6.59 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.91 146.66 28.35 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.56 -38.72 91.99 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 107.769 -1.196 . . . . 0.0 107.769 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -66.84 -44.93 79.8 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.7 m -62.56 -43.13 99.57 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.1 m -65.66 -38.18 88.6 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.506 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.6 t60 -64.44 -38.7 91.93 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -59.74 -39.79 85.92 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.02 -37.06 84.94 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.4 t60 -70.12 -37.92 75.45 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 35' ' ' HIS . 53.6 t -67.13 -37.39 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.7 mttt -64.42 -37.44 87.52 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 70.8 t60 -63.99 -42.31 97.25 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.472 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.7 m -60.0 -46.34 89.81 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -70.73 -33.45 70.86 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.54 -37.98 86.14 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.27 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.34 -39.28 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.816 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.472 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -63.24 -31.99 73.27 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.0 m -93.53 -44.95 7.97 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.887 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -39.97 63.02 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.609 -1.397 . . . . 0.0 109.609 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.01 69.71 9.94 Favored Pre-proline 0 C--N 1.351 0.645 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 C--O 1.26 1.609 0 C-N-CA 122.596 2.198 . . . . 0.0 112.436 179.539 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.052 0.453 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 95.1 p -155.5 160.2 40.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.9 m -81.44 129.38 66.33 Favored Pre-proline 0 N--CA 1.438 -1.031 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -62.36 -61.42 0.15 Allowed 'Trans proline' 0 CA--C 1.496 -1.379 0 C-N-CA 122.379 2.053 . . . . 0.0 112.48 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -161.98 -134.03 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.633 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.54 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.36 -2.296 . . . . 0.0 107.36 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.74 -33.55 10.54 Favored 'General case' 0 CA--C 1.49 -1.332 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.27 -36.79 83.16 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.643 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.1 p -69.81 -25.25 27.9 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.592 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.97 -24.62 67.79 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.22 -42.1 56.23 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 179.521 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.31 -44.96 84.61 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.1 t60 -71.1 -39.3 72.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.68 -52.19 66.72 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.7 m -71.1 -26.83 63.21 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.608 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 56.0 t80 -62.8 -47.03 85.2 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.7 p -62.83 -38.42 90.7 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.9 mptt -64.74 -31.65 72.98 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.622 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.8 t80 -73.93 -48.44 30.6 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.608 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.15 -37.76 72.53 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 t -64.55 -35.56 81.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t -67.03 -38.38 85.78 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -70.23 -22.71 62.88 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.4 mmt -86.22 -15.93 39.32 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -71.26 162.24 29.76 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.3 13.18 12.13 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -80.76 -9.01 59.84 Favored 'General case' 0 CA--C 1.485 -1.548 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -87.79 79.77 8.06 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -86.91 -29.56 22.03 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.7 t0 -139.49 176.32 8.82 Favored 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.13 -38.14 87.43 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.39 -40.84 98.33 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.451 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.0 m -62.1 -41.33 98.1 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.31 -30.26 67.2 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.74 -37.52 86.61 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -60.37 -37.41 80.67 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.8 m -63.03 -39.72 95.6 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -71.35 -38.51 71.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.54 -38.28 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.9 mtpt -65.05 -37.43 87.56 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.622 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 72.9 t60 -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.468 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.18 -45.98 91.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -70.45 -33.87 71.79 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.5 t -66.8 -38.69 86.99 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.12 -39.47 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.851 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.468 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.53 -30.62 71.71 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -92.45 -46.49 7.63 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 119.652 -0.819 . . . . 0.0 108.961 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.53 -39.75 55.64 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 69.85 11.5 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -177.646 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 C--O 1.263 1.736 0 C-N-CA 122.503 2.135 . . . . 0.0 112.328 179.537 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.6 t -152.84 145.57 24.32 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.5 m -79.37 129.48 71.95 Favored Pre-proline 0 N--CA 1.437 -1.102 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -62.65 -61.79 0.13 Allowed 'Trans proline' 0 CA--C 1.497 -1.364 0 C-N-CA 122.379 2.053 . . . . 0.0 112.417 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -161.33 -134.05 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.94 0.02 OUTLIER Glycine 0 C--N 1.341 0.853 0 N-CA-C 107.312 -2.315 . . . . 0.0 107.312 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.3 m -99.76 -33.59 10.51 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.632 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.14 -36.51 82.03 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 179.671 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.53 -25.11 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.64 -24.57 67.84 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.26 -42.06 55.92 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.18 -44.83 83.93 Favored 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.69 -39.1 70.45 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -58.8 -52.18 66.8 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -70.92 -27.37 63.72 Favored 'General case' 0 CA--C 1.489 -1.395 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.622 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 53.1 t80 -62.54 -47.19 84.97 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.06 -38.05 89.65 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.22 -31.61 72.86 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.624 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.9 t80 -73.94 -47.85 34.68 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.32 -37.24 72.2 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -64.02 -36.78 85.1 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.1 t -67.61 -37.16 82.12 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -69.32 -24.42 63.92 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.0 mmt -86.15 -16.17 38.73 Favored 'General case' 0 CA--C 1.493 -1.231 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.4 m -68.11 161.5 26.75 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.17 2.34 24.64 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.9 m -80.52 -11.77 59.62 Favored 'General case' 0 CA--C 1.493 -1.226 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.2 t -91.15 69.15 6.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -114.34 -33.55 5.59 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.52 154.45 20.85 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.94 -39.51 90.54 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.02 -43.59 78.46 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.1 m -63.03 -41.69 99.58 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.8 m -67.7 -36.07 79.96 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.428 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.5 t60 -63.55 -36.42 83.74 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.74 -36.21 76.15 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 72.7 m -62.3 -39.96 94.71 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -72.17 -38.45 69.13 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -64.99 -38.11 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.997 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -64.72 -37.57 88.03 Favored 'General case' 0 CA--C 1.486 -1.485 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.624 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 75.9 t60 -64.31 -41.72 96.69 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.9 m -60.35 -46.47 89.83 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.02 -33.57 70.48 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.2 t -66.85 -37.94 85.41 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.41 -39.37 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.833 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.6 m-20 -62.59 -32.21 73.17 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -93.97 -44.84 7.87 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.621 -0.831 . . . . 0.0 108.997 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.09 -40.25 62.11 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.15 69.85 9.86 Favored Pre-proline 0 C--N 1.35 0.619 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -177.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 C--O 1.262 1.687 0 C-N-CA 122.686 2.258 . . . . 0.0 112.409 179.675 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.035 0.445 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.1 t -152.63 147.01 25.64 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.9 m -78.0 130.48 72.61 Favored Pre-proline 0 N--CA 1.438 -1.032 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.552 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 68.3 Cg_exo -52.35 -42.55 59.92 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.556 2.171 . . . . 0.0 112.853 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -155.73 -134.09 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.33 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 107.41 -2.276 . . . . 0.0 107.41 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.9 m -100.37 -34.37 9.99 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.626 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.42 -36.11 81.35 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.8 -25.22 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -63.46 -24.78 67.97 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.0 -42.22 57.9 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 25.9 mmt180 -57.11 -44.95 83.73 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -70.96 -38.46 72.8 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.7 -53.24 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.6 -27.62 64.23 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.732 -1.211 . . . . 0.0 107.732 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.503 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.7 t80 -61.46 -48.91 78.97 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.6 p -63.29 -37.34 86.86 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.02 -28.2 69.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.2 t80 -81.55 -46.78 13.96 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.503 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 22.3 mmmt -58.39 -30.51 66.88 Favored 'General case' 0 CA--C 1.478 -1.825 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.32 -35.03 71.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -69.86 -41.88 74.25 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -64.88 -26.91 68.52 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.27 -23.41 35.29 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.0 m -76.38 169.78 17.59 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.75 9.82 25.78 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.6 m -79.82 -11.4 59.83 Favored 'General case' 0 CA--C 1.492 -1.265 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.07 63.37 3.7 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -102.15 -33.0 9.83 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -110.92 149.47 30.59 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 35' ' ' HIS . 98.9 mt-10 -65.72 -38.44 89.16 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.06 -43.13 83.45 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.9 m -62.36 -42.42 99.39 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -70.29 -32.15 69.8 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.514 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.7 t60 -65.29 -38.53 90.52 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -60.06 -39.28 85.45 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 55.9 m -66.22 -37.17 84.9 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.15 -38.04 75.37 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 35' ' ' HIS . 52.9 t -66.99 -37.54 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.4 mttt -64.58 -37.24 86.87 Favored 'General case' 0 CA--C 1.486 -1.491 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.586 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 71.3 t60 -63.9 -41.74 97.62 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.437 HG22 ' ND2' ' A' ' 46' ' ' ASN . 38.2 m -60.41 -46.38 90.22 Favored 'General case' 0 N--CA 1.436 -1.125 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.04 -33.34 70.21 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 31.5 t -66.38 -38.08 86.73 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.22 -39.37 35.19 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.941 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.437 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -63.49 -31.44 72.6 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.7 m -92.93 -45.4 7.98 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.868 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.28 -40.06 61.34 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.626 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -148.47 69.86 10.5 Favored Pre-proline 0 C--N 1.349 0.565 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.261 1.672 0 C-N-CA 122.67 2.246 . . . . 0.0 112.46 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 120.983 0.42 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -153.52 145.42 23.56 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -78.11 129.47 75.47 Favored Pre-proline 0 N--CA 1.438 -1.025 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.81 -62.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.497 -1.348 0 C-N-CA 122.332 2.021 . . . . 0.0 112.508 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.1 t70 -162.01 -134.28 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.93 -30.98 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.34 -2.304 . . . . 0.0 107.34 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.9 m -99.51 -33.41 10.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.2 -36.34 81.64 Favored 'General case' 0 N--CA 1.428 -1.575 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 179.619 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.4 p -70.56 -25.09 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.587 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.59 -24.56 67.85 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.47 -42.15 53.85 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.556 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.42 -44.99 85.09 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.96 -39.22 72.69 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.99 -52.44 65.77 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.2 m -71.16 -26.65 63.07 Favored 'General case' 0 CA--C 1.49 -1.327 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.453 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.7 t80 -61.99 -48.67 79.29 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 65.4 p -62.83 -37.99 88.95 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.85 -30.53 71.16 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -74.86 -48.66 23.82 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.2 mmmt -58.97 -37.77 77.55 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.7 m -65.38 -28.56 69.35 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.8 t -71.5 -39.01 71.11 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -71.43 -22.84 61.79 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.2 mmt -84.33 -16.94 41.17 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -70.81 163.91 26.32 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -87.1 19.86 2.94 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.2 m -90.82 -6.98 53.56 Favored 'General case' 0 CA--C 1.478 -1.797 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.88 75.56 8.06 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 106.503 -1.665 . . . . 0.0 106.503 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -89.84 -32.63 16.82 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -136.25 174.46 10.59 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' HIS . 99.2 mt-10 -67.2 -37.07 83.04 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.52 -43.12 98.09 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.8 m -62.97 -41.39 99.52 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.0 m -66.68 -36.26 82.1 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 39' ' ' VAL . 81.2 t60 -63.43 -37.26 86.59 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -59.93 -38.14 81.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 68.7 m -63.13 -39.62 95.22 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -70.49 -38.51 74.37 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.59 -37.65 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.75 -37.35 87.32 Favored 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.9 t60 -64.2 -42.1 96.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.1 m -60.19 -46.43 89.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.9 -34.03 71.16 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.75 -38.43 86.62 Favored 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -75.64 -39.36 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.763 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -63.28 -31.58 72.76 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -178.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.6 m -91.51 -47.17 7.57 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.904 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.27 -40.12 61.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.19 11.51 Favored Pre-proline 0 C--N 1.35 0.614 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -177.859 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.631 2.221 . . . . 0.0 112.383 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.976 0.417 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 t -152.81 146.5 25.11 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.1 m -78.39 130.81 70.46 Favored Pre-proline 0 N--CA 1.437 -1.095 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.549 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 72.1 Cg_exo -52.06 -42.62 57.86 Favored 'Trans proline' 0 CA--C 1.497 -1.35 0 C-N-CA 122.633 2.222 . . . . 0.0 112.795 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -154.93 -138.63 0.07 Allowed 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -159.29 -31.17 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 -179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 m -100.0 -34.41 10.1 Favored 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.86 -35.99 81.8 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.607 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.2 p -70.47 -24.68 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.51 -24.67 67.92 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.13 55.68 Favored 'General case' 0 CA--C 1.495 -1.146 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.44 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.26 -44.85 84.28 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -71.1 -38.99 72.35 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.96 -52.44 65.75 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.92 -26.87 63.39 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.0 -48.54 79.85 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.3 p -62.79 -37.96 88.77 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.89 -30.24 70.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.631 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.09 -48.66 22.76 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.68 -37.41 75.99 Favored 'General case' 0 CA--C 1.489 -1.382 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.4 m -64.85 -32.88 74.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.5 t -68.83 -39.05 80.2 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -70.94 -21.37 62.36 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 14.5 mtm -89.13 -5.52 57.71 Favored 'General case' 0 CA--C 1.487 -1.442 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.1 m -79.98 164.82 23.17 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.04 13.03 13.92 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.9 m -82.28 -8.37 59.64 Favored 'General case' 0 CA--C 1.487 -1.455 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.5 t -86.84 79.03 8.93 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -87.28 -29.36 21.69 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.9 t0 -139.28 175.49 9.52 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -66.47 -38.01 86.38 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.1 m -62.16 -41.04 97.91 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -70.28 -30.88 68.0 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.443 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.3 t60 -66.09 -36.9 84.4 Favored 'General case' 0 CA--C 1.501 -0.918 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -60.05 -36.99 78.52 Favored 'General case' 0 CA--C 1.495 -1.173 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 73.3 m -62.87 -39.84 95.66 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.6 t60 -71.13 -38.76 72.28 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.1 t -65.38 -37.98 81.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.077 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -65.05 -37.17 86.71 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.631 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 76.5 t60 -64.02 -41.82 97.31 Favored 'General case' 0 CA--C 1.497 -1.063 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.3 m -60.31 -46.31 90.34 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.13 -33.89 70.52 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.61 -37.98 86.0 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -76.28 -39.24 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.455 ' ND2' HG22 ' A' ' 42' ' ' THR . 60.0 m-20 -62.57 -32.18 73.11 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.3 m -94.05 -44.71 7.91 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.88 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.93 -40.26 63.32 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.36 69.72 9.67 Favored Pre-proline 0 C--N 1.349 0.583 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.955 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.638 2.225 . . . . 0.0 112.414 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.743 0 CA-C-O 121.01 0.433 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.1 p -155.03 160.97 41.44 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.9 m -82.16 130.0 61.69 Favored Pre-proline 0 N--CA 1.437 -1.077 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.567 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 69.6 Cg_exo -52.21 -42.49 59.48 Favored 'Trans proline' 0 CA--C 1.498 -1.29 0 C-N-CA 122.621 2.214 . . . . 0.0 112.773 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -154.61 -134.72 0.05 OUTLIER 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.66 -31.53 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 107.414 -2.274 . . . . 0.0 107.414 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -100.2 -34.7 9.91 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.66 -36.42 82.8 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -70.29 -25.35 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.54 -24.44 67.81 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.2 -42.3 55.93 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.554 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.17 -44.86 83.9 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.88 -39.31 72.9 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -58.92 -52.24 66.59 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.2 m -70.97 -26.85 63.33 Favored 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.469 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -62.14 -48.44 80.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 72.4 p -62.72 -38.27 89.83 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.28 -31.28 72.34 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 179.597 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.644 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.5 t80 -73.99 -49.16 25.68 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.469 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.4 mmmt -58.07 -37.16 73.94 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.3 t -63.48 -37.11 86.03 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.9 t -67.18 -37.34 83.54 Favored 'General case' 0 C--N 1.348 0.526 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.8 mm100 -69.81 -19.95 63.47 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 13.9 mtm -90.37 -3.15 57.91 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.5 p -73.9 166.57 23.11 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -86.46 1.53 51.09 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -87.37 -8.2 56.87 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.9 t -87.48 65.56 8.67 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.757 -1.572 . . . . 0.0 106.757 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.8 p80 -114.51 -30.91 6.39 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -104.04 149.83 24.82 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -64.77 -39.14 93.11 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -67.42 -44.35 79.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.6 m -62.52 -42.5 99.55 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 86.6 m -67.29 -36.36 81.38 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.7 t60 -63.27 -36.33 83.3 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.58 -36.19 75.75 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 69.8 m -62.29 -40.08 95.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -71.6 -38.84 70.82 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -65.3 -37.57 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -64.45 -37.62 88.16 Favored 'General case' 0 CA--C 1.486 -1.482 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 77.7 t60 -64.2 -42.2 96.75 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.8 m -60.22 -46.54 89.39 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -70.92 -33.86 70.95 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.7 t -66.99 -37.99 85.22 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.03 -39.48 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.844 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.2 m-20 -62.79 -31.84 72.89 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.6 m -93.6 -45.36 7.76 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.672 -0.811 . . . . 0.0 108.949 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.12 -40.25 61.93 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.643 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -148.96 69.17 9.87 Favored Pre-proline 0 C--N 1.349 0.567 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.882 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo . . . . . 0 C--O 1.261 1.644 0 C-N-CA 122.858 2.372 . . . . 0.0 112.698 179.587 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 120.997 0.427 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 t -153.16 145.3 23.81 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.8 m -79.23 129.16 73.41 Favored Pre-proline 0 N--CA 1.437 -1.103 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.85 -62.71 0.1 Allowed 'Trans proline' 0 CA--C 1.497 -1.361 0 C-N-CA 122.366 2.044 . . . . 0.0 112.518 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -161.47 -133.8 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.65 -30.63 0.02 OUTLIER Glycine 0 C--N 1.341 0.825 0 N-CA-C 107.295 -2.322 . . . . 0.0 107.295 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 m -99.77 -33.58 10.52 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.62 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.61 82.33 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.632 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.556 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.59 -25.55 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -63.72 -24.34 67.73 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.21 -41.87 56.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.05 -44.82 83.36 Favored 'General case' 0 N--CA 1.428 -1.544 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.45 -38.78 71.28 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.02 -52.4 65.94 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.0 m -70.77 -27.09 63.67 Favored 'General case' 0 CA--C 1.49 -1.359 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.44 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.1 t80 -61.8 -48.73 79.31 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.3 p -62.76 -38.04 89.0 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.443 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.25 -31.09 72.06 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.8 t80 -74.42 -48.74 25.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.4 mmmt -58.4 -36.46 73.6 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.1 m -64.12 -34.74 78.75 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.8 t -69.84 -37.39 76.16 Favored 'General case' 0 C--N 1.349 0.562 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -68.15 -24.85 65.03 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 73.4 mtm -93.41 -2.85 54.17 Favored 'General case' 0 CA--C 1.487 -1.468 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -78.86 163.43 25.3 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.18 14.06 13.53 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.4 m -82.73 -7.34 59.66 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.7 t -86.33 78.64 9.26 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -87.94 -27.55 22.06 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.441 ' H ' ' HB2' ' A' ' 33' ' ' SER . 3.6 t0 -139.1 173.99 10.98 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.69 -37.93 85.74 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.42 -40.63 97.71 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.441 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 71.0 m -61.73 -41.12 97.23 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -33.47 72.98 Favored 'General case' 0 C--N 1.352 0.692 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.431 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.0 t60 -65.34 -37.2 86.35 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -60.14 -36.35 77.32 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.2 m -62.24 -40.18 95.31 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -71.62 -39.12 70.67 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.09 -37.45 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.62 -37.61 88.15 Favored 'General case' 0 CA--C 1.486 -1.488 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 78.2 t60 -64.55 -41.85 96.08 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.8 m -60.31 -46.81 88.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.41 -33.21 69.24 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 t -67.14 -37.84 84.51 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.0 t -76.69 -39.5 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -62.61 -32.37 73.38 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.9 m -94.11 -44.63 7.92 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 119.628 -0.829 . . . . 0.0 108.861 -178.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.88 -40.37 63.8 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.62 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.76 69.95 9.41 Favored Pre-proline 0 C--N 1.35 0.589 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.712 0 C-N-CA 122.648 2.232 . . . . 0.0 112.444 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.063 0.458 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -131.55 147.49 52.54 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.7 m -80.5 129.34 69.26 Favored Pre-proline 0 N--CA 1.438 -1.049 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.76 -62.19 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.373 0 C-N-CA 122.344 2.029 . . . . 0.0 112.461 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -161.36 -133.64 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.85 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.864 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.5 m -99.62 -33.61 10.55 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.629 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.19 -36.69 82.65 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.7 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.559 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.37 -25.14 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.97 -24.27 67.66 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.48 -42.17 53.63 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.471 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -57.38 -44.81 84.75 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -71.31 -39.72 71.26 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.91 -51.81 68.43 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.2 m -70.15 -29.79 66.78 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.493 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 41.5 t80 -61.42 -49.29 77.46 Favored 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 61.9 p -63.44 -38.24 90.37 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -63.45 -29.31 70.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.591 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.6 t80 -80.38 -47.38 14.51 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.4 mmmt -58.02 -30.57 66.22 Favored 'General case' 0 CA--C 1.48 -1.731 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.7 t -58.45 -35.4 72.06 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 40.1 t -69.45 -41.99 75.51 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.66 -25.58 68.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 -179.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.5 mmt -84.87 -21.21 29.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.4 m -77.37 167.03 22.37 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -87.99 6.01 38.0 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.0 m -80.13 -12.58 59.65 Favored 'General case' 0 CA--C 1.495 -1.167 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.8 t -92.67 65.28 4.27 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -110.79 -32.1 6.96 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -103.12 146.22 28.72 Favored 'General case' 0 CA--C 1.487 -1.473 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -64.73 -38.83 92.33 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -66.87 -44.96 79.58 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.2 m -62.43 -43.15 99.5 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.3 -38.57 90.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.504 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.0 t60 -64.82 -38.97 92.77 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -59.73 -39.4 84.61 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 56.2 m -65.98 -37.21 85.38 Favored 'General case' 0 CA--C 1.498 -1.058 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -70.5 -37.92 74.23 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 35' ' ' HIS . 54.8 t -67.25 -37.27 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 44' ' ' CYS . 9.8 mttt -64.07 -37.4 87.31 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.591 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 71.5 t60 -64.04 -42.55 97.04 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.476 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.7 m -60.06 -46.57 89.12 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -70.8 -33.1 70.37 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' LYS . 34.0 t -66.49 -37.89 86.06 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -76.82 -39.62 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.921 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.476 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.01 -32.73 74.16 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -93.78 -44.56 8.07 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.907 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.01 -40.19 62.62 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.629 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.23 69.7 9.77 Favored Pre-proline 0 C--N 1.35 0.597 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.957 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.261 1.652 0 C-N-CA 122.665 2.244 . . . . 0.0 112.432 179.59 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.07 0.462 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.0 p -156.25 160.69 40.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.8 m -81.45 127.43 73.37 Favored Pre-proline 0 N--CA 1.439 -1.009 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.51 -63.63 0.06 OUTLIER 'Trans proline' 0 CA--C 1.499 -1.259 0 C-N-CA 122.402 2.068 . . . . 0.0 112.537 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -161.98 -133.79 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.628 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.29 0.02 OUTLIER Glycine 0 C--N 1.342 0.901 0 N-CA-C 107.313 -2.315 . . . . 0.0 107.313 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -99.9 -33.43 10.53 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.13 -36.27 81.27 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.599 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.553 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.32 -25.01 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.62 -24.67 67.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.16 -42.07 56.8 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.594 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.1 -44.97 83.71 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.17 -39.01 72.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -58.98 -52.34 66.16 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 88.7 m -71.09 -27.2 63.44 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.452 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -61.94 -48.5 80.11 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.1 p -62.63 -38.12 89.01 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 -179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.11 -31.78 73.16 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 7.0 t80 -73.81 -49.21 26.34 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.23 -36.7 73.55 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.5 t -62.23 -36.42 81.94 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 11.3 t -68.46 -37.69 80.42 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -68.69 -24.35 64.49 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.3 mmt -85.85 -16.17 39.52 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -69.0 160.66 30.53 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.54 2.11 23.37 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.5 m -80.59 -10.66 59.73 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.91 69.92 5.51 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -115.37 -33.64 5.22 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -105.47 150.97 24.84 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.97 -39.05 93.26 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -67.51 -44.27 78.83 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -63.25 -41.75 99.1 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.9 m -67.09 -36.14 81.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 39' ' ' VAL . 78.4 t60 -63.53 -37.12 86.11 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -59.82 -35.16 74.14 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -179.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 84.7 m -62.46 -39.97 95.12 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.9 t60 -73.75 -36.53 65.13 Favored 'General case' 0 CA--C 1.498 -1.031 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 35' ' ' HIS . 51.1 t -65.82 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.02 -28.02 65.15 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 -179.376 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 73.2 t60 -70.75 -40.45 72.7 Favored 'General case' 0 CA--C 1.49 -1.364 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.452 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.2 m -61.18 -46.16 91.66 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.61 -33.55 69.08 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.3 t -66.52 -37.99 86.22 Favored 'General case' 0 CA--C 1.481 -1.674 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.53 -39.39 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.83 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.452 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.6 m-20 -62.72 -32.26 73.33 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.4 m -94.03 -44.69 7.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.599 -0.841 . . . . 0.0 108.901 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.2 63.06 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -178.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.69 69.95 9.47 Favored Pre-proline 0 C--N 1.35 0.6 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -177.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.263 1.743 0 C-N-CA 122.636 2.224 . . . . 0.0 112.416 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 t70 . . . . . 0 N--CA 1.427 -1.62 0 N-CA-C 107.192 -1.411 . . . . 0.0 107.192 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.11 -31.27 0.02 OUTLIER Glycine 0 C--N 1.343 0.921 0 N-CA-C 107.366 -2.294 . . . . 0.0 107.366 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.75 -33.74 10.46 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.637 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.66 82.19 Favored 'General case' 0 N--CA 1.428 -1.54 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.562 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.52 -25.91 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.53 -24.66 67.9 Favored 'General case' 0 CA--C 1.504 -0.821 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.14 -42.31 56.49 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.4 -45.06 84.94 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -70.86 -39.31 72.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.1 t70 -59.17 -52.06 67.31 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.9 m -70.94 -26.9 63.38 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.02 -48.37 80.57 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.3 p -62.44 -38.76 91.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.4 mptt -65.14 -31.14 72.18 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.1 t80 -74.3 -49.23 23.86 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.92 76.41 Favored 'General case' 0 CA--C 1.487 -1.448 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.6 t -62.77 -34.51 77.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.3 t . . . . . 0 C--N 1.348 0.522 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.5 -0.962 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.6 m -62.05 -40.67 96.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.92 -30.42 63.89 Favored 'General case' 0 C--N 1.349 0.578 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.422 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -65.54 -36.48 83.93 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.86 -36.41 76.8 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 82.5 m -62.42 -40.0 95.12 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -71.38 -38.95 71.5 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.37 -37.57 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttm -64.65 -37.5 87.79 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.3 t-80 -64.48 -42.04 96.13 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.1 m -60.55 -46.48 90.02 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -71.07 -33.69 70.47 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.3 t -66.92 -38.5 86.32 Favored 'General case' 0 CA--C 1.48 -1.729 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.88 -39.46 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.481 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.92 -32.23 73.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.0 m -91.71 -46.94 7.64 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.916 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.92 -40.4 63.28 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.637 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.06 11.48 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -177.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 C--O 1.262 1.713 0 C-N-CA 122.616 2.211 . . . . 0.0 112.393 179.48 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.2 t70 . . . . . 0 N--CA 1.432 -1.358 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.67 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.36 -34.45 9.96 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.639 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.3 -36.32 81.76 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -70.49 -24.84 25.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -179.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.78 -24.35 67.73 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.37 -42.07 54.88 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.32 -44.85 84.54 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -71.05 -39.16 72.43 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.0 -52.31 66.3 Favored 'General case' 0 C--O 1.219 -0.515 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.1 m -70.97 -27.0 63.41 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.46 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.1 t80 -61.98 -48.6 79.61 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.78 -37.91 88.51 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.53 -31.15 72.06 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.642 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.32 -48.65 26.94 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.27 -37.08 74.27 Favored 'General case' 0 CA--C 1.488 -1.423 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -63.22 -34.54 77.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t . . . . . 0 CA--C 1.51 -0.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.7 m -63.14 -41.66 99.34 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.6 m -67.36 -36.03 80.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.3 t60 -63.47 -36.18 82.89 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -59.62 -36.75 76.93 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.3 m -62.23 -39.98 94.63 Favored 'General case' 0 CA--C 1.496 -1.11 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -71.44 -38.62 71.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.07 -37.52 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.989 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -64.76 -37.32 87.21 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.642 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.6 t-80 -64.23 -41.89 96.81 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.461 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.8 m -60.24 -46.33 90.16 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.98 -33.93 70.9 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.93 -37.9 85.18 Favored 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.29 -39.3 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.461 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.0 m-20 -62.5 -32.36 73.27 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -94.07 -44.68 7.91 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.896 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.27 63.5 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.639 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.48 69.85 9.61 Favored Pre-proline 0 C--N 1.349 0.581 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 -177.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.677 2.252 . . . . 0.0 112.444 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.432 -1.373 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.66 -31.56 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 N-CA-C 107.305 -2.318 . . . . 0.0 107.305 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.0 m -100.39 -34.24 10.04 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.36 -36.21 81.52 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.63 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.547 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.69 -24.82 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.548 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.52 -24.66 67.91 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.06 55.82 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.24 -44.85 84.22 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -71.04 -39.11 72.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.96 -52.48 65.57 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.7 m -70.94 -26.89 63.38 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.03 -48.54 79.79 Favored 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.2 p -62.94 -38.08 89.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.68 -30.25 70.91 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.633 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -75.16 -49.09 20.62 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.29 -37.99 76.11 Favored 'General case' 0 CA--C 1.49 -1.356 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.9 t -63.66 -35.32 80.16 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 16.6 t . . . . . 0 C--N 1.348 0.514 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 -179.7 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.503 -0.827 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.1 m -62.23 -41.25 98.23 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -30.87 68.28 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.453 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -66.07 -37.14 85.08 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -60.29 -37.15 79.59 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.5 m -62.9 -39.89 95.89 Favored 'General case' 0 CA--C 1.497 -1.068 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -71.03 -38.79 72.58 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.3 t -65.18 -37.92 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -65.11 -37.16 86.57 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.633 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.4 t-80 -64.03 -41.66 97.34 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.453 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.16 -46.56 89.27 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.29 -33.68 69.95 Favored 'General case' 0 C--N 1.344 0.349 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.0 t -66.8 -37.88 85.41 Favored 'General case' 0 CA--C 1.482 -1.653 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.5 -39.32 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.799 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.453 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.4 m-20 -62.64 -32.29 73.3 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.0 m -94.02 -44.61 7.97 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 119.643 -0.823 . . . . 0.0 108.923 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.34 62.97 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -178.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.59 69.97 9.55 Favored Pre-proline 0 C--N 1.349 0.571 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -177.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.262 1.692 0 C-N-CA 122.646 2.231 . . . . 0.0 112.393 179.672 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 . . . . . 0 N--CA 1.427 -1.583 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.48 -30.4 0.02 OUTLIER Glycine 0 C--N 1.341 0.844 0 N-CA-C 107.309 -2.317 . . . . 0.0 107.309 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.4 m -99.74 -33.35 10.62 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -69.94 -25.23 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -24.17 67.61 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.44 -41.64 55.35 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -57.35 -44.89 84.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -71.22 -38.95 71.98 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 21.8 t70 -58.97 -52.41 65.87 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.1 m -70.84 -26.78 63.43 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.06 -48.44 80.24 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.72 -38.7 91.51 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -64.85 -31.16 72.26 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.4 t80 -74.03 -49.67 23.19 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.8 mmmt -58.29 -37.83 75.81 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.3 t -63.37 -34.85 78.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.1 t . . . . . 0 CA--C 1.512 -0.494 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.701 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.501 -0.924 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -61.97 -41.29 97.85 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -31.22 68.5 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.458 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.5 t60 -65.78 -37.4 86.2 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -60.21 -36.99 78.91 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 82.6 m -62.84 -39.97 96.01 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -71.2 -38.67 72.07 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.32 -38.04 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.5 mtpt -64.81 -37.37 87.4 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.6 t-80 -63.85 -42.14 97.64 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.8 m -60.18 -46.14 90.71 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.03 -33.73 70.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.1 t -66.94 -37.94 85.24 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.33 -39.22 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.828 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.6 m-20 -62.53 -32.51 73.46 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -94.25 -44.4 7.98 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 119.549 -0.86 . . . . 0.0 108.885 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -40.16 62.76 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.64 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.62 69.74 9.48 Favored Pre-proline 0 C--N 1.35 0.593 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 -177.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.652 2.234 . . . . 0.0 112.398 179.646 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 N--CA 1.433 -1.31 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.68 -31.6 0.02 OUTLIER Glycine 0 CA--C 1.501 -0.819 0 N-CA-C 107.38 -2.288 . . . . 0.0 107.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.0 m -100.58 -34.33 9.94 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.633 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.09 -36.79 82.75 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.636 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -69.97 -24.94 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -63.94 -24.7 67.83 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.24 -41.93 56.39 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.03 -45.03 83.45 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -70.9 -39.0 73.01 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -58.71 -52.62 64.93 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.1 -26.72 63.16 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.6 t80 -62.21 -48.61 79.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 67.4 p -62.74 -38.17 89.45 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.95 -29.95 70.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.626 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.36 -48.66 21.96 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.8 -38.0 77.62 Favored 'General case' 0 CA--C 1.491 -1.323 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 73.6 m -65.71 -28.09 68.81 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.509 -0.625 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.725 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.502 -0.898 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -62.1 -41.44 98.21 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -30.39 67.27 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.461 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -65.83 -37.47 86.32 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -60.36 -37.12 79.72 Favored 'General case' 0 CA--C 1.494 -1.175 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.2 m -63.07 -39.77 95.69 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.93 -38.81 72.92 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.7 t -65.35 -38.16 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -64.94 -37.34 87.33 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.4 t-80 -63.78 -41.97 97.84 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.477 HG22 ' ND2' ' A' ' 46' ' ' ASN . 33.1 m -60.13 -46.14 90.66 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.16 -33.66 70.23 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.8 t -66.86 -37.94 85.39 Favored 'General case' 0 CA--C 1.482 -1.664 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.47 -39.32 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.883 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.477 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.1 m-20 -62.36 -32.44 73.23 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.3 m -94.32 -44.43 7.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.914 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.85 -40.37 64.07 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.633 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.71 69.73 9.41 Favored Pre-proline 0 C--N 1.349 0.568 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 -177.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.264 1.777 0 C-N-CA 122.654 2.236 . . . . 0.0 112.389 179.59 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.7 t70 . . . . . 0 N--CA 1.426 -1.655 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.66 -30.3 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 N-CA-C 107.314 -2.314 . . . . 0.0 107.314 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.4 m -99.73 -33.44 10.58 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.08 -36.53 81.95 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.05 -25.2 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.9 -24.38 67.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.3 -41.92 55.84 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -57.23 -44.87 84.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.28 -39.08 71.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.3 t70 -58.75 -52.65 64.78 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -70.7 -27.05 63.7 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.432 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 46.8 t80 -62.01 -48.63 79.42 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.0 p -62.99 -38.32 90.7 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -65.52 -30.08 70.8 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.1 t80 -75.42 -49.19 19.68 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.3 mmmt -58.54 -38.66 78.26 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -67.4 -27.31 66.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.8 t . . . . . 0 CA--C 1.507 -0.69 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.613 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.503 -0.865 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.6 m -61.98 -41.5 98.09 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.96 -31.23 68.85 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.438 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.1 t60 -65.8 -37.51 86.46 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.12 -37.23 79.42 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 71.8 m -62.65 -39.71 94.73 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -70.87 -38.92 73.11 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.76 -38.06 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -65.39 -37.0 85.67 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 39.9 t-80 -63.68 -42.05 98.08 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.466 HG22 ' ND2' ' A' ' 46' ' ' ASN . 35.7 m -60.03 -46.25 90.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.36 -33.33 69.47 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 t -66.83 -37.9 85.4 Favored 'General case' 0 CA--C 1.48 -1.719 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.71 -39.46 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.871 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.466 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.56 -32.57 73.56 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -178.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -94.01 -44.35 8.09 Favored 'General case' 0 CA--C 1.509 -0.614 0 C-N-CA 119.65 -0.82 . . . . 0.0 108.938 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.1 -40.12 62.23 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.85 69.82 9.32 Favored Pre-proline 0 C--N 1.349 0.58 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -177.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 C--O 1.262 1.718 0 C-N-CA 122.546 2.164 . . . . 0.0 112.48 179.535 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 . . . . . 0 N--CA 1.427 -1.591 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.99 -30.69 0.02 OUTLIER Glycine 0 C--N 1.342 0.885 0 N-CA-C 107.354 -2.298 . . . . 0.0 107.354 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 m -99.63 -33.42 10.63 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.64 82.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.22 -25.27 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -24.14 67.65 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.6 -41.72 53.76 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.27 -44.9 84.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.59 -38.83 70.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.98 -52.41 65.89 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.7 m -70.74 -27.11 63.71 Favored 'General case' 0 CA--C 1.49 -1.337 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.423 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.5 t80 -61.85 -48.6 79.82 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.2 p -62.87 -38.4 90.72 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.12 -30.82 71.79 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.645 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.4 -49.52 22.26 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.3 mmmt -58.16 -37.95 75.67 Favored 'General case' 0 CA--C 1.491 -1.321 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.2 t -64.1 -34.98 79.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 18.1 t . . . . . 0 CA--C 1.511 -0.539 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 73.3 tp60 . . . . . 0 CA--C 1.504 -0.802 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.5 m -62.9 -40.69 98.34 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.14 -32.64 72.14 Favored 'General case' 0 C--N 1.351 0.66 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.423 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -66.06 -36.91 84.47 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -60.03 -36.31 77.0 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.7 m -62.71 -39.99 95.76 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -71.46 -38.87 71.26 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.55 -37.63 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -64.78 -37.16 86.67 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.2 t-80 -64.0 -42.16 97.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.456 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.9 m -60.03 -46.48 89.37 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.27 -33.39 69.72 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.7 t -66.97 -37.84 84.99 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.52 -39.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.826 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.456 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -62.55 -32.64 73.63 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.8 m -94.24 -44.37 8.0 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.961 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.9 -40.27 63.6 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.7 69.7 9.41 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.261 1.673 0 C-N-CA 122.674 2.249 . . . . 0.0 112.462 179.665 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.433 -1.315 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.6 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 107.369 -2.293 . . . . 0.0 107.369 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.25 -34.45 10.0 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.32 -36.48 82.31 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 179.584 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.549 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.41 -24.89 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.48 -24.94 68.04 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -74.99 -41.98 58.44 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -57.26 -44.93 84.37 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -70.94 -38.88 72.87 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.91 -52.61 64.99 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.2 m -70.77 -27.17 63.73 Favored 'General case' 0 CA--C 1.49 -1.336 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.45 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.4 t80 -61.88 -48.67 79.45 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.7 p -62.77 -37.89 88.43 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.49 -31.24 72.21 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.9 t80 -74.62 -48.33 27.08 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.7 mmmt -58.76 -37.58 76.56 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -65.11 -28.24 69.3 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.508 -0.656 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 -179.883 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.505 -0.758 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.5 t -62.76 -42.58 99.75 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.23 -30.09 68.17 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -65.72 -35.46 80.8 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.03 -35.24 74.67 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 76.5 m -62.31 -40.22 95.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -71.55 -38.82 70.96 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.17 -37.85 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 1.4 mtpp -65.08 -37.11 86.45 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.3 t-80 -64.09 -41.65 97.22 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.457 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.8 m -60.28 -46.49 89.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.26 -33.53 69.88 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.3 t -66.76 -37.86 85.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.58 -39.27 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.872 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.457 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.5 m-20 -62.64 -32.31 73.33 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -93.9 -44.71 7.96 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.869 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.26 63.56 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.62 69.93 9.52 Favored Pre-proline 0 C--N 1.349 0.564 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.263 1.731 0 C-N-CA 122.685 2.256 . . . . 0.0 112.439 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 . . . . . 0 N--CA 1.427 -1.607 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.87 -30.32 0.02 OUTLIER Glycine 0 C--N 1.341 0.837 0 N-CA-C 107.335 -2.306 . . . . 0.0 107.335 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.8 m -99.86 -33.31 10.6 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.04 -36.36 81.37 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.548 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.43 -24.96 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.52 -24.7 67.93 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.21 -42.0 56.5 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.08 -44.87 83.53 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.3 -38.93 71.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.93 -52.45 65.7 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -71.05 -26.77 63.22 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.447 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.0 t80 -62.08 -48.61 79.42 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -62.85 -38.15 89.66 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.46 -30.5 71.29 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.635 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.1 t80 -75.0 -49.07 21.07 Favored 'General case' 0 N--CA 1.433 -1.294 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.64 75.85 Favored 'General case' 0 CA--C 1.488 -1.407 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.1 t -63.35 -35.3 79.94 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 CA--C 1.513 -0.458 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.704 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 . . . . . 0 CA--C 1.501 -0.934 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.5 m -62.32 -40.63 96.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -30.95 66.53 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -66.57 -35.96 81.48 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -59.76 -35.49 74.71 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 74.6 m -62.08 -40.37 95.58 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -71.95 -38.69 69.75 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.92 -37.91 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.7 mtpt -64.85 -37.31 87.18 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.7 t-80 -64.13 -41.91 97.02 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.462 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.7 m -60.27 -46.59 89.3 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.22 -33.61 70.04 Favored 'General case' 0 C--N 1.343 0.304 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 t -66.94 -37.82 85.02 Favored 'General case' 0 CA--C 1.483 -1.617 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.69 -39.32 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.758 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.462 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.0 m-20 -62.5 -32.48 73.4 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.9 m -93.93 -44.73 7.94 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.965 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.07 -40.27 62.22 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.52 69.99 9.61 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.723 0 C-N-CA 122.687 2.258 . . . . 0.0 112.389 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 . . . . . 0 N--CA 1.427 -1.577 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.4 -30.87 0.02 OUTLIER Glycine 0 C--N 1.343 0.944 0 N-CA-C 107.228 -2.349 . . . . 0.0 107.228 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.2 m -99.55 -33.33 10.69 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.29 -36.62 82.65 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.632 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.64 -26.1 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.69 -24.14 67.66 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.49 -41.89 54.3 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.39 -44.99 84.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -71.93 -38.49 69.85 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.43 -52.42 65.7 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.38 -26.65 62.88 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 -178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.615 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 55.4 t80 -63.05 -47.21 83.96 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.8 p -62.6 -38.14 89.0 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.79 -31.29 72.18 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.465 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.599 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.6 t80 -74.26 -47.28 36.11 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.615 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -58.13 -38.2 76.07 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -67.5 -27.57 67.1 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.508 -0.649 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.72 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 CA--C 1.503 -0.861 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m -61.95 -41.53 98.08 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -30.45 67.33 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.79 -37.72 87.04 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -60.41 -37.37 80.61 Favored 'General case' 0 CA--C 1.495 -1.162 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 70.1 m -63.06 -39.63 95.3 Favored 'General case' 0 CA--C 1.495 -1.168 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -70.95 -38.94 72.86 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.77 -38.27 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.6 mtpt -65.26 -37.77 88.24 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.599 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.9 t-80 -63.84 -42.06 97.69 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.3 m -60.06 -46.18 90.42 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -71.01 -33.43 70.36 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.9 t -66.88 -38.09 85.64 Favored 'General case' 0 CA--C 1.482 -1.645 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.76 -39.52 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.81 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -179.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.7 m-20 -63.47 -31.5 72.68 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 85.3 m -91.9 -46.89 7.61 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.728 -0.789 . . . . 0.0 108.891 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.34 -40.27 60.76 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 70.19 11.57 Favored Pre-proline 0 C--N 1.351 0.643 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -177.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 C--O 1.263 1.774 0 C-N-CA 122.564 2.176 . . . . 0.0 112.373 179.487 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.427 -1.578 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.82 -30.27 0.02 OUTLIER Glycine 0 C--N 1.341 0.831 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.5 m -99.66 -33.51 10.58 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.1 -36.35 81.46 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.24 -25.4 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.77 -24.59 67.83 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.05 -42.06 57.83 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 179.481 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -57.22 -44.9 84.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.48 -38.55 71.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.71 -52.89 63.79 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.1 m -70.71 -27.7 64.18 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.502 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.4 t80 -61.42 -48.92 78.99 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.3 -37.36 86.95 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.452 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -64.76 -28.6 69.69 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.605 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.7 t80 -81.02 -47.24 13.87 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.0 mmmt -58.31 -30.31 66.57 Favored 'General case' 0 CA--C 1.48 -1.742 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.44 -35.29 71.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 CA--C 1.507 -0.707 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.7 m -62.56 -43.13 99.57 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.1 m -65.66 -38.18 88.6 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.506 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.6 t60 -64.44 -38.7 91.93 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -59.74 -39.79 85.92 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.02 -37.06 84.94 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.4 t60 -70.12 -37.92 75.45 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 35' ' ' HIS . 53.6 t -67.13 -37.39 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.7 mttt -64.42 -37.44 87.52 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 32.7 t-80 -63.99 -42.31 97.25 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.472 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.7 m -60.0 -46.34 89.81 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -70.73 -33.45 70.86 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.54 -37.98 86.14 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.34 -39.28 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.816 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.472 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -63.24 -31.99 73.27 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.0 m -93.53 -44.95 7.97 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.887 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -39.97 63.02 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.609 -1.397 . . . . 0.0 109.609 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.01 69.71 9.94 Favored Pre-proline 0 C--N 1.351 0.645 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 C--O 1.26 1.609 0 C-N-CA 122.596 2.198 . . . . 0.0 112.436 179.539 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.426 -1.633 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.54 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.36 -2.296 . . . . 0.0 107.36 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.74 -33.55 10.54 Favored 'General case' 0 CA--C 1.49 -1.332 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.27 -36.79 83.16 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.643 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.1 p -69.81 -25.25 27.9 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.592 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.97 -24.62 67.79 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.22 -42.1 56.23 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 179.521 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.31 -44.96 84.61 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.1 t60 -71.1 -39.3 72.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.68 -52.19 66.72 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.7 m -71.1 -26.83 63.21 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.608 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 56.0 t80 -62.8 -47.03 85.2 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.7 p -62.83 -38.42 90.7 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.9 mptt -64.74 -31.65 72.98 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.622 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.8 t80 -73.93 -48.44 30.6 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.608 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.15 -37.76 72.53 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 t -64.55 -35.56 81.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t . . . . . 0 CA--C 1.514 -0.437 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.503 -0.85 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.0 m -62.1 -41.33 98.1 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.31 -30.26 67.2 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.74 -37.52 86.61 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -60.37 -37.41 80.67 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.8 m -63.03 -39.72 95.6 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -71.35 -38.51 71.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.54 -38.28 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.9 mtpt -65.05 -37.43 87.56 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.622 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.2 t-80 -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.468 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.18 -45.98 91.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -70.45 -33.87 71.79 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.5 t -66.8 -38.69 86.99 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.12 -39.47 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.851 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.468 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.53 -30.62 71.71 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -92.45 -46.49 7.63 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 119.652 -0.819 . . . . 0.0 108.961 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.53 -39.75 55.64 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 69.85 11.5 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -177.646 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 C--O 1.263 1.736 0 C-N-CA 122.503 2.135 . . . . 0.0 112.328 179.537 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 N--CA 1.427 -1.597 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.94 0.02 OUTLIER Glycine 0 C--N 1.341 0.853 0 N-CA-C 107.312 -2.315 . . . . 0.0 107.312 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.3 m -99.76 -33.59 10.51 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.632 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.14 -36.51 82.03 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 179.671 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.53 -25.11 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.64 -24.57 67.84 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.26 -42.06 55.92 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.18 -44.83 83.93 Favored 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.69 -39.1 70.45 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -58.8 -52.18 66.8 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -70.92 -27.37 63.72 Favored 'General case' 0 CA--C 1.489 -1.395 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.622 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 53.1 t80 -62.54 -47.19 84.97 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.06 -38.05 89.65 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.22 -31.61 72.86 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.624 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.9 t80 -73.94 -47.85 34.68 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.32 -37.24 72.2 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -64.02 -36.78 85.1 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.1 t . . . . . 0 CA--C 1.511 -0.542 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 . . . . . 0 CA--C 1.506 -0.731 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.1 m -63.03 -41.69 99.58 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.8 m -67.7 -36.07 79.96 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.428 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.5 t60 -63.55 -36.42 83.74 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.74 -36.21 76.15 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 72.7 m -62.3 -39.96 94.71 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -72.17 -38.45 69.13 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -64.99 -38.11 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.997 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -64.72 -37.57 88.03 Favored 'General case' 0 CA--C 1.486 -1.485 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.624 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 40.0 t-80 -64.31 -41.72 96.69 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.9 m -60.35 -46.47 89.83 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.02 -33.57 70.48 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.2 t -66.85 -37.94 85.41 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.41 -39.37 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.833 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.6 m-20 -62.59 -32.21 73.17 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -93.97 -44.84 7.87 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.621 -0.831 . . . . 0.0 108.997 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.09 -40.25 62.11 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.15 69.85 9.86 Favored Pre-proline 0 C--N 1.35 0.619 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -177.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 C--O 1.262 1.687 0 C-N-CA 122.686 2.258 . . . . 0.0 112.409 179.675 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 . . . . . 0 N--CA 1.432 -1.352 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.33 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 107.41 -2.276 . . . . 0.0 107.41 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.9 m -100.37 -34.37 9.99 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.626 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.42 -36.11 81.35 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.8 -25.22 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -63.46 -24.78 67.97 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.0 -42.22 57.9 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 25.9 mmt180 -57.11 -44.95 83.73 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -70.96 -38.46 72.8 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.7 -53.24 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.6 -27.62 64.23 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.732 -1.211 . . . . 0.0 107.732 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.503 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.7 t80 -61.46 -48.91 78.97 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.6 p -63.29 -37.34 86.86 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.02 -28.2 69.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.2 t80 -81.55 -46.78 13.96 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.503 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 22.3 mmmt -58.39 -30.51 66.88 Favored 'General case' 0 CA--C 1.478 -1.825 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.32 -35.03 71.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t . . . . . 0 CA--C 1.507 -0.692 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.996 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.9 m -62.36 -42.42 99.39 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -70.29 -32.15 69.8 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.514 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.7 t60 -65.29 -38.53 90.52 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -60.06 -39.28 85.45 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 55.9 m -66.22 -37.17 84.9 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.15 -38.04 75.37 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 35' ' ' HIS . 52.9 t -66.99 -37.54 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.4 mttt -64.58 -37.24 86.87 Favored 'General case' 0 CA--C 1.486 -1.491 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.586 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.5 t-80 -63.9 -41.74 97.62 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.437 HG22 ' ND2' ' A' ' 46' ' ' ASN . 38.2 m -60.41 -46.38 90.22 Favored 'General case' 0 N--CA 1.436 -1.125 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.04 -33.34 70.21 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 31.5 t -66.38 -38.08 86.73 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.22 -39.37 35.19 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.941 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.437 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -63.49 -31.44 72.6 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.7 m -92.93 -45.4 7.98 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.868 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.28 -40.06 61.34 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.626 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -148.47 69.86 10.5 Favored Pre-proline 0 C--N 1.349 0.565 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.261 1.672 0 C-N-CA 122.67 2.246 . . . . 0.0 112.46 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.1 t70 . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.93 -30.98 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.34 -2.304 . . . . 0.0 107.34 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.9 m -99.51 -33.41 10.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.2 -36.34 81.64 Favored 'General case' 0 N--CA 1.428 -1.575 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 179.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.4 p -70.56 -25.09 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.587 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.59 -24.56 67.85 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.47 -42.15 53.85 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.556 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.42 -44.99 85.09 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.96 -39.22 72.69 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.99 -52.44 65.77 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.2 m -71.16 -26.65 63.07 Favored 'General case' 0 CA--C 1.49 -1.327 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.453 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.7 t80 -61.99 -48.67 79.29 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 65.4 p -62.83 -37.99 88.95 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.85 -30.53 71.16 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -74.86 -48.66 23.82 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.2 mmmt -58.97 -37.77 77.55 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.7 m -65.38 -28.56 69.35 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.8 t . . . . . 0 CA--C 1.508 -0.645 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.503 -0.841 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.8 m -62.97 -41.39 99.52 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.0 m -66.68 -36.26 82.1 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 39' ' ' VAL . 81.2 t60 -63.43 -37.26 86.59 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -59.93 -38.14 81.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 68.7 m -63.13 -39.62 95.22 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -70.49 -38.51 74.37 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.59 -37.65 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.75 -37.35 87.32 Favored 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.3 t-80 -64.2 -42.1 96.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.1 m -60.19 -46.43 89.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.9 -34.03 71.16 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.75 -38.43 86.62 Favored 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -75.64 -39.36 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.763 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -63.28 -31.58 72.76 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -178.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.6 m -91.51 -47.17 7.57 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.904 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.27 -40.12 61.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.19 11.51 Favored Pre-proline 0 C--N 1.35 0.614 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -177.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.631 2.221 . . . . 0.0 112.383 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -159.29 -31.17 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 -179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 m -100.0 -34.41 10.1 Favored 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.86 -35.99 81.8 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.607 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.2 p -70.47 -24.68 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.51 -24.67 67.92 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.13 55.68 Favored 'General case' 0 CA--C 1.495 -1.146 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.44 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.26 -44.85 84.28 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -71.1 -38.99 72.35 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.96 -52.44 65.75 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.92 -26.87 63.39 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.0 -48.54 79.85 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.3 p -62.79 -37.96 88.77 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.89 -30.24 70.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.631 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.09 -48.66 22.76 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.68 -37.41 75.99 Favored 'General case' 0 CA--C 1.489 -1.382 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.4 m -64.85 -32.88 74.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.51 -0.56 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -179.766 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.504 -0.82 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.1 m -62.16 -41.04 97.91 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -70.28 -30.88 68.0 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.443 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.3 t60 -66.09 -36.9 84.4 Favored 'General case' 0 CA--C 1.501 -0.918 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -60.05 -36.99 78.52 Favored 'General case' 0 CA--C 1.495 -1.173 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 73.3 m -62.87 -39.84 95.66 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.6 t60 -71.13 -38.76 72.28 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.1 t -65.38 -37.98 81.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.077 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -65.05 -37.17 86.71 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.631 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.5 t-80 -64.02 -41.82 97.31 Favored 'General case' 0 CA--C 1.497 -1.063 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.3 m -60.31 -46.31 90.34 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.13 -33.89 70.52 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.61 -37.98 86.0 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -76.28 -39.24 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.455 ' ND2' HG22 ' A' ' 42' ' ' THR . 60.0 m-20 -62.57 -32.18 73.11 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.3 m -94.05 -44.71 7.91 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.88 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.93 -40.26 63.32 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.36 69.72 9.67 Favored Pre-proline 0 C--N 1.349 0.583 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.638 2.225 . . . . 0.0 112.414 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 N--CA 1.433 -1.306 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.66 -31.53 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 107.414 -2.274 . . . . 0.0 107.414 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -100.2 -34.7 9.91 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.66 -36.42 82.8 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -70.29 -25.35 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.54 -24.44 67.81 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.2 -42.3 55.93 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.554 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.17 -44.86 83.9 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.88 -39.31 72.9 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -58.92 -52.24 66.59 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.2 m -70.97 -26.85 63.33 Favored 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.469 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -62.14 -48.44 80.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 72.4 p -62.72 -38.27 89.83 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.28 -31.28 72.34 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 179.597 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.644 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.5 t80 -73.99 -49.16 25.68 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.469 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.4 mmmt -58.07 -37.16 73.94 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.3 t -63.48 -37.11 86.03 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.9 t . . . . . 0 C--N 1.348 0.526 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 . . . . . 0 CA--C 1.507 -0.684 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.6 m -62.52 -42.5 99.55 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 86.6 m -67.29 -36.36 81.38 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.7 t60 -63.27 -36.33 83.3 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.58 -36.19 75.75 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 69.8 m -62.29 -40.08 95.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -71.6 -38.84 70.82 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -65.3 -37.57 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -64.45 -37.62 88.16 Favored 'General case' 0 CA--C 1.486 -1.482 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.1 t-80 -64.2 -42.2 96.75 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.8 m -60.22 -46.54 89.39 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -70.92 -33.86 70.95 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.7 t -66.99 -37.99 85.22 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.03 -39.48 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.844 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.2 m-20 -62.79 -31.84 72.89 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.6 m -93.6 -45.36 7.76 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.672 -0.811 . . . . 0.0 108.949 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.12 -40.25 61.93 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.643 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -148.96 69.17 9.87 Favored Pre-proline 0 C--N 1.349 0.567 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.882 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo . . . . . 0 C--O 1.261 1.644 0 C-N-CA 122.858 2.372 . . . . 0.0 112.698 179.587 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 . . . . . 0 N--CA 1.426 -1.647 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.65 -30.63 0.02 OUTLIER Glycine 0 C--N 1.341 0.825 0 N-CA-C 107.295 -2.322 . . . . 0.0 107.295 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 m -99.77 -33.58 10.52 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.62 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.61 82.33 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.632 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.556 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.59 -25.55 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -63.72 -24.34 67.73 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.21 -41.87 56.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.05 -44.82 83.36 Favored 'General case' 0 N--CA 1.428 -1.544 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.45 -38.78 71.28 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.02 -52.4 65.94 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.0 m -70.77 -27.09 63.67 Favored 'General case' 0 CA--C 1.49 -1.359 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.44 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.1 t80 -61.8 -48.73 79.31 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.3 p -62.76 -38.04 89.0 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.443 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.25 -31.09 72.06 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.8 t80 -74.42 -48.74 25.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.4 mmmt -58.4 -36.46 73.6 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.1 m -64.12 -34.74 78.75 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.8 t . . . . . 0 C--N 1.349 0.562 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 CA--C 1.501 -0.906 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m -61.73 -41.12 97.23 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -33.47 72.98 Favored 'General case' 0 C--N 1.352 0.692 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.431 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.0 t60 -65.34 -37.2 86.35 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -60.14 -36.35 77.32 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.2 m -62.24 -40.18 95.31 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -71.62 -39.12 70.67 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.09 -37.45 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.62 -37.61 88.15 Favored 'General case' 0 CA--C 1.486 -1.488 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 44.3 t-80 -64.55 -41.85 96.08 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.8 m -60.31 -46.81 88.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.41 -33.21 69.24 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 t -67.14 -37.84 84.51 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.0 t -76.69 -39.5 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -62.61 -32.37 73.38 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.9 m -94.11 -44.63 7.92 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 119.628 -0.829 . . . . 0.0 108.861 -178.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.88 -40.37 63.8 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.62 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.76 69.95 9.41 Favored Pre-proline 0 C--N 1.35 0.589 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.712 0 C-N-CA 122.648 2.232 . . . . 0.0 112.444 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.427 -1.576 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.85 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.864 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.5 m -99.62 -33.61 10.55 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.629 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.19 -36.69 82.65 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.7 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.559 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.37 -25.14 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.97 -24.27 67.66 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.48 -42.17 53.63 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.471 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -57.38 -44.81 84.75 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -71.31 -39.72 71.26 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.91 -51.81 68.43 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.2 m -70.15 -29.79 66.78 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.493 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 41.5 t80 -61.42 -49.29 77.46 Favored 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 61.9 p -63.44 -38.24 90.37 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -63.45 -29.31 70.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.591 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.6 t80 -80.38 -47.38 14.51 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.4 mmmt -58.02 -30.57 66.22 Favored 'General case' 0 CA--C 1.48 -1.731 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.7 t -58.45 -35.4 72.06 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 40.1 t . . . . . 0 CA--C 1.505 -0.75 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.995 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 . . . . . 0 CA--C 1.508 -0.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.2 m -62.43 -43.15 99.5 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.3 -38.57 90.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.504 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.0 t60 -64.82 -38.97 92.77 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -59.73 -39.4 84.61 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 56.2 m -65.98 -37.21 85.38 Favored 'General case' 0 CA--C 1.498 -1.058 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -70.5 -37.92 74.23 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 35' ' ' HIS . 54.8 t -67.25 -37.27 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 44' ' ' CYS . 9.8 mttt -64.07 -37.4 87.31 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.591 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.2 t-80 -64.04 -42.55 97.04 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.476 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.7 m -60.06 -46.57 89.12 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -70.8 -33.1 70.37 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' LYS . 34.0 t -66.49 -37.89 86.06 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -76.82 -39.62 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.921 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.476 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.01 -32.73 74.16 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -93.78 -44.56 8.07 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.907 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.01 -40.19 62.62 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.629 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.23 69.7 9.77 Favored Pre-proline 0 C--N 1.35 0.597 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.261 1.652 0 C-N-CA 122.665 2.244 . . . . 0.0 112.432 179.59 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.426 -1.628 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.29 0.02 OUTLIER Glycine 0 C--N 1.342 0.901 0 N-CA-C 107.313 -2.315 . . . . 0.0 107.313 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -99.9 -33.43 10.53 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.13 -36.27 81.27 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.553 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.32 -25.01 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.62 -24.67 67.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.16 -42.07 56.8 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.1 -44.97 83.71 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.17 -39.01 72.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -58.98 -52.34 66.16 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 88.7 m -71.09 -27.2 63.44 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.452 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -61.94 -48.5 80.11 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.1 p -62.63 -38.12 89.01 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 -179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.11 -31.78 73.16 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 7.0 t80 -73.81 -49.21 26.34 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.23 -36.7 73.55 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.5 t -62.23 -36.42 81.94 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 11.3 t . . . . . 0 CA--C 1.511 -0.548 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 CA--C 1.509 -0.626 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -63.25 -41.75 99.1 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.9 m -67.09 -36.14 81.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 39' ' ' VAL . 78.4 t60 -63.53 -37.12 86.11 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -59.82 -35.16 74.14 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -179.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 84.7 m -62.46 -39.97 95.12 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.9 t60 -73.75 -36.53 65.13 Favored 'General case' 0 CA--C 1.498 -1.031 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 35' ' ' HIS . 51.1 t -65.82 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.02 -28.02 65.15 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 -179.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.6 t-80 -70.75 -40.45 72.7 Favored 'General case' 0 CA--C 1.49 -1.364 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.452 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.2 m -61.18 -46.16 91.66 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.61 -33.55 69.08 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.3 t -66.52 -37.99 86.22 Favored 'General case' 0 CA--C 1.481 -1.674 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.53 -39.39 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.83 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.452 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.6 m-20 -62.72 -32.26 73.33 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.4 m -94.03 -44.69 7.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.599 -0.841 . . . . 0.0 108.901 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.2 63.06 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -178.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.69 69.95 9.47 Favored Pre-proline 0 C--N 1.35 0.6 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -177.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.263 1.743 0 C-N-CA 122.636 2.224 . . . . 0.0 112.416 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.97 0.414 . . . . 0.0 110.162 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 98.3 p -155.59 163.18 40.29 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 55.3 p -75.96 150.98 83.99 Favored Pre-proline 0 N--CA 1.431 -1.402 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.88 -61.51 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.333 0 C-N-CA 122.418 2.079 . . . . 0.0 112.415 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -161.88 -134.94 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 107.192 -1.411 . . . . 0.0 107.192 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.11 -31.27 0.02 OUTLIER Glycine 0 C--N 1.343 0.921 0 N-CA-C 107.366 -2.294 . . . . 0.0 107.366 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.75 -33.74 10.46 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.637 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.66 82.19 Favored 'General case' 0 N--CA 1.428 -1.54 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.562 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.52 -25.91 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.613 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.53 -24.66 67.9 Favored 'General case' 0 CA--C 1.504 -0.821 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.14 -42.31 56.49 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.4 -45.06 84.94 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -70.86 -39.31 72.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.405 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.1 t70 -59.17 -52.06 67.31 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.9 m -70.94 -26.9 63.38 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.442 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.02 -48.37 80.57 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.3 p -62.44 -38.76 91.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.4 mptt -65.14 -31.14 72.18 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.1 t80 -74.3 -49.23 23.86 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.92 76.41 Favored 'General case' 0 CA--C 1.487 -1.448 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.6 t -62.77 -34.51 77.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.3 t -67.62 -38.35 83.79 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -69.88 -25.39 63.68 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.2 mmt -81.19 -19.11 44.02 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -70.36 163.64 26.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -81.97 7.71 12.41 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.5 m -78.59 -14.78 59.16 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.7 t -89.18 67.84 8.03 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -105.78 -30.11 9.62 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.47 163.77 15.56 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -70.69 -40.5 72.88 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -68.69 -40.98 79.8 Favored 'General case' 0 CA--C 1.5 -0.962 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.6 m -62.05 -40.67 96.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.92 -30.42 63.89 Favored 'General case' 0 C--N 1.349 0.578 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.422 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -65.54 -36.48 83.93 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -59.86 -36.41 76.8 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.418 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 82.5 m -62.42 -40.0 95.12 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -71.38 -38.95 71.5 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.37 -37.57 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttm -64.65 -37.5 87.79 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.3 t-80 -64.48 -42.04 96.13 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.1 m -60.55 -46.48 90.02 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -71.07 -33.69 70.47 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.3 t -66.92 -38.5 86.32 Favored 'General case' 0 CA--C 1.48 -1.729 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.88 -39.46 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.481 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.92 -32.23 73.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.0 m -91.71 -46.94 7.64 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.752 -0.779 . . . . 0.0 108.916 -178.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.92 -40.4 63.28 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.637 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.06 11.48 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -177.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo . . . . . 0 C--O 1.262 1.713 0 C-N-CA 122.616 2.211 . . . . 0.0 112.393 179.48 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 121.034 0.445 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.0 t -151.76 146.84 26.03 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 32.9 m -78.63 130.47 70.85 Favored Pre-proline 0 N--CA 1.437 -1.097 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.561 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 66.3 Cg_exo -52.32 -42.7 58.84 Favored 'Trans proline' 0 CA--C 1.498 -1.309 0 C-N-CA 122.622 2.214 . . . . 0.0 112.847 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -155.08 -133.85 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.67 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.36 -34.45 9.96 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 106.347 -1.723 . . . . 0.0 106.347 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.639 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.3 -36.32 81.76 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -70.49 -24.84 25.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -179.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.78 -24.35 67.73 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.37 -42.07 54.88 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.32 -44.85 84.54 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -71.05 -39.16 72.43 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.0 -52.31 66.3 Favored 'General case' 0 C--O 1.219 -0.515 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.1 m -70.97 -27.0 63.41 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.46 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.1 t80 -61.98 -48.6 79.61 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.78 -37.91 88.51 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.53 -31.15 72.06 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.642 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.32 -48.65 26.94 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.27 -37.08 74.27 Favored 'General case' 0 CA--C 1.488 -1.423 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -63.22 -34.54 77.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t -69.28 -37.14 77.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -69.28 -23.93 63.9 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.8 mmt -84.9 -16.35 41.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.8 m -68.12 160.13 29.59 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.21 1.84 23.22 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -80.93 -10.56 59.7 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.7 t -91.84 70.32 5.6 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.7 p80 -115.43 -34.03 5.07 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -105.36 151.1 24.61 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.93 -39.16 93.52 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.46 -44.2 79.21 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.7 m -63.14 -41.66 99.34 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.6 m -67.36 -36.03 80.55 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.424 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.3 t60 -63.47 -36.18 82.89 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -59.62 -36.75 76.93 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.3 m -62.23 -39.98 94.63 Favored 'General case' 0 CA--C 1.496 -1.11 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -71.44 -38.62 71.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.07 -37.52 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.989 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -64.76 -37.32 87.21 Favored 'General case' 0 CA--C 1.488 -1.418 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.642 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.6 t-80 -64.23 -41.89 96.81 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.461 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.8 m -60.24 -46.33 90.16 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.98 -33.93 70.9 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.93 -37.9 85.18 Favored 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.29 -39.3 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.461 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.0 m-20 -62.5 -32.36 73.27 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -94.07 -44.68 7.91 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.896 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.27 63.5 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.639 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.48 69.85 9.61 Favored Pre-proline 0 C--N 1.349 0.581 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 -177.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.677 2.252 . . . . 0.0 112.444 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.02 0.438 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.8 t -152.3 146.93 25.78 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.6 m -78.05 130.69 71.84 Favored Pre-proline 0 N--CA 1.437 -1.077 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.556 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 59.7 Cg_exo -52.33 -43.03 56.92 Favored 'Trans proline' 0 CA--C 1.497 -1.362 0 C-N-CA 122.645 2.23 . . . . 0.0 112.762 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -156.17 -133.38 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.66 -31.56 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 N-CA-C 107.305 -2.318 . . . . 0.0 107.305 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.0 m -100.39 -34.24 10.04 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.36 -36.21 81.52 Favored 'General case' 0 N--CA 1.428 -1.549 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.63 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.547 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.69 -24.82 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.548 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.52 -24.66 67.91 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.06 55.82 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.24 -44.85 84.22 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -71.04 -39.11 72.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.96 -52.48 65.57 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.7 m -70.94 -26.89 63.38 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.03 -48.54 79.79 Favored 'General case' 0 CA--C 1.498 -1.043 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.2 p -62.94 -38.08 89.64 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.68 -30.25 70.91 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.633 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -75.16 -49.09 20.62 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.29 -37.99 76.11 Favored 'General case' 0 CA--C 1.49 -1.356 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.9 t -63.66 -35.32 80.16 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 16.6 t -66.62 -38.94 88.0 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -70.34 -22.45 62.8 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 34.9 mmt -85.54 -15.85 41.37 Favored 'General case' 0 CA--C 1.491 -1.325 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.0 m -70.45 162.05 29.42 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -87.9 13.69 10.36 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.0 m -81.56 -8.48 59.72 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.2 t -86.76 78.8 9.02 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -87.01 -28.24 22.75 Favored 'General case' 0 CA--C 1.5 -0.972 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.8 t0 -139.93 175.09 9.88 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.52 -37.63 85.43 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -63.23 -40.85 98.63 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.427 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 71.1 m -62.23 -41.25 98.23 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -30.87 68.28 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.453 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.2 t60 -66.07 -37.14 85.08 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -60.29 -37.15 79.59 Favored 'General case' 0 CA--C 1.494 -1.18 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.5 m -62.9 -39.89 95.89 Favored 'General case' 0 CA--C 1.497 -1.068 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -71.03 -38.79 72.58 Favored 'General case' 0 CA--C 1.495 -1.156 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.3 t -65.18 -37.92 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -65.11 -37.16 86.57 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.633 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.4 t-80 -64.03 -41.66 97.34 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.453 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.16 -46.56 89.27 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.29 -33.68 69.95 Favored 'General case' 0 C--N 1.344 0.349 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.0 t -66.8 -37.88 85.41 Favored 'General case' 0 CA--C 1.482 -1.653 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.5 -39.32 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.799 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.453 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.4 m-20 -62.64 -32.29 73.3 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.0 m -94.02 -44.61 7.97 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 119.643 -0.823 . . . . 0.0 108.923 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.34 62.97 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -178.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.59 69.97 9.55 Favored Pre-proline 0 C--N 1.349 0.571 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -177.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.262 1.692 0 C-N-CA 122.646 2.231 . . . . 0.0 112.393 179.672 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 121.087 0.47 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.9 t -152.94 145.81 24.46 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -78.76 129.51 73.54 Favored Pre-proline 0 N--CA 1.439 -1.013 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -64.47 -62.55 0.09 OUTLIER 'Trans proline' 0 CA--C 1.498 -1.314 0 C-N-CA 122.322 2.015 . . . . 0.0 112.498 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 -162.82 -133.85 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.583 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.48 -30.4 0.02 OUTLIER Glycine 0 C--N 1.341 0.844 0 N-CA-C 107.309 -2.317 . . . . 0.0 107.309 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.4 m -99.74 -33.35 10.62 Favored 'General case' 0 CA--C 1.493 -1.235 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.64 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.9 p -69.94 -25.23 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -64.02 -24.17 67.61 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.44 -41.64 55.35 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 179.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -57.35 -44.89 84.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -71.22 -38.95 71.98 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 21.8 t70 -58.97 -52.41 65.87 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -178.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.1 m -70.84 -26.78 63.43 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.4 t80 -62.06 -48.44 80.24 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.4 p -62.72 -38.7 91.51 Favored 'General case' 0 CA--C 1.505 -0.756 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -64.85 -31.16 72.26 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.4 t80 -74.03 -49.67 23.19 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.8 mmmt -58.29 -37.83 75.81 Favored 'General case' 0 CA--C 1.49 -1.349 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.3 t -63.37 -34.85 78.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.1 t -66.55 -39.4 88.52 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -70.49 -23.19 62.63 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 34.6 mmt -83.79 -17.49 40.93 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.0 m -71.45 163.2 28.15 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -88.23 13.68 10.97 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -80.14 -9.06 59.69 Favored 'General case' 0 CA--C 1.486 -1.499 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.3 t -87.19 78.95 8.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -87.19 -30.18 21.19 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.462 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.2 t0 -138.32 175.9 9.17 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.47 -38.26 86.92 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.74 -40.64 97.23 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.462 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.2 m -61.97 -41.29 97.85 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.26 -31.22 68.5 Favored 'General case' 0 C--N 1.352 0.701 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.458 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.5 t60 -65.78 -37.4 86.2 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -60.21 -36.99 78.91 Favored 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 82.6 m -62.84 -39.97 96.01 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -71.2 -38.67 72.07 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.32 -38.04 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.5 mtpt -64.81 -37.37 87.4 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.6 t-80 -63.85 -42.14 97.64 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.8 m -60.18 -46.14 90.71 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.03 -33.73 70.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.1 t -66.94 -37.94 85.24 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.33 -39.22 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.828 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 61.6 m-20 -62.53 -32.51 73.46 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -178.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -94.25 -44.4 7.98 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 119.549 -0.86 . . . . 0.0 108.885 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -40.16 62.76 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.64 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.62 69.74 9.48 Favored Pre-proline 0 C--N 1.35 0.593 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 -177.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.262 1.686 0 C-N-CA 122.652 2.234 . . . . 0.0 112.398 179.646 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.496 1.863 0 CA-C-O 120.977 0.418 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.8 m -131.19 148.61 52.73 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 32.3 m -79.16 130.57 68.91 Favored Pre-proline 0 N--CA 1.437 -1.084 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.561 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 65.4 Cg_exo -52.07 -42.71 57.41 Favored 'Trans proline' 0 CA--C 1.497 -1.337 0 C-N-CA 122.513 2.142 . . . . 0.0 112.795 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -155.81 -133.0 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.31 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.68 -31.6 0.02 OUTLIER Glycine 0 CA--C 1.501 -0.819 0 N-CA-C 107.38 -2.288 . . . . 0.0 107.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.0 m -100.58 -34.33 9.94 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.633 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.09 -36.79 82.75 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.636 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -69.97 -24.94 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -63.94 -24.7 67.83 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.24 -41.93 56.39 Favored 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.03 -45.03 83.45 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -70.9 -39.0 73.01 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -58.71 -52.62 64.93 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.1 -26.72 63.16 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.6 t80 -62.21 -48.61 79.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 67.4 p -62.74 -38.17 89.45 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.421 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.95 -29.95 70.44 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.626 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.36 -48.66 21.96 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.8 -38.0 77.62 Favored 'General case' 0 CA--C 1.491 -1.323 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 73.6 m -65.71 -28.09 68.81 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 14.3 t -71.35 -39.27 71.41 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -70.53 -22.83 62.58 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.5 mmt -83.46 -17.52 41.76 Favored 'General case' 0 CA--C 1.492 -1.28 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.1 m -70.58 162.79 28.24 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -88.0 13.41 11.09 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -81.45 -8.81 59.78 Favored 'General case' 0 CA--C 1.486 -1.517 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.1 t -87.78 79.29 8.2 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -86.92 -29.61 21.97 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.9 t0 -139.32 175.98 9.1 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.32 -38.03 86.73 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.37 -40.69 97.94 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.443 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.7 m -62.1 -41.44 98.21 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -30.39 67.27 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.461 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -65.83 -37.47 86.32 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -60.36 -37.12 79.72 Favored 'General case' 0 CA--C 1.494 -1.175 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 75.2 m -63.07 -39.77 95.69 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.93 -38.81 72.92 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.7 t -65.35 -38.16 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -64.94 -37.34 87.33 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.4 t-80 -63.78 -41.97 97.84 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.477 HG22 ' ND2' ' A' ' 46' ' ' ASN . 33.1 m -60.13 -46.14 90.66 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.16 -33.66 70.23 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.8 t -66.86 -37.94 85.39 Favored 'General case' 0 CA--C 1.482 -1.664 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.47 -39.32 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.883 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.477 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.1 m-20 -62.36 -32.44 73.23 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.3 m -94.32 -44.43 7.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.914 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.85 -40.37 64.07 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.633 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.71 69.73 9.41 Favored Pre-proline 0 C--N 1.349 0.568 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 -177.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.264 1.777 0 C-N-CA 122.654 2.236 . . . . 0.0 112.389 179.59 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.031 0.443 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -132.31 148.42 52.43 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.8 m -79.54 129.12 72.69 Favored Pre-proline 0 N--CA 1.438 -1.053 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -63.84 -62.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.384 2.056 . . . . 0.0 112.493 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.7 t70 -162.46 -133.75 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.655 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.66 -30.3 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 N-CA-C 107.314 -2.314 . . . . 0.0 107.314 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.4 m -99.73 -33.44 10.58 Favored 'General case' 0 CA--C 1.491 -1.317 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.08 -36.53 81.95 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.05 -25.2 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -63.9 -24.38 67.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.3 -41.92 55.84 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -57.23 -44.87 84.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.28 -39.08 71.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' HD3' ' A' ' 18' ' ' LYS . 22.3 t70 -58.75 -52.65 64.78 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -70.7 -27.05 63.7 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.432 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 46.8 t80 -62.01 -48.63 79.42 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.0 p -62.99 -38.32 90.7 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 4.0 mptt -65.52 -30.08 70.8 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.1 t80 -75.42 -49.19 19.68 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.3 mmmt -58.54 -38.66 78.26 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.0 m -67.4 -27.31 66.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.8 t -71.02 -40.53 71.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -71.14 -22.9 62.01 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.3 mmt -83.23 -17.0 44.24 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.0 m -70.91 163.97 26.36 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -86.74 12.74 10.1 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.6 m -80.99 -8.98 59.89 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.0 t -87.87 79.47 8.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -85.52 -28.61 24.83 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' H ' ' HB2' ' A' ' 33' ' ' SER . 2.2 t0 -140.99 175.95 9.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -65.93 -37.98 87.46 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -63.04 -40.73 98.59 Favored 'General case' 0 CA--C 1.503 -0.865 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.6 m -61.98 -41.5 98.09 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.96 -31.23 68.85 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.438 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.1 t60 -65.8 -37.51 86.46 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.12 -37.23 79.42 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 71.8 m -62.65 -39.71 94.73 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -70.87 -38.92 73.11 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.76 -38.06 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -65.39 -37.0 85.67 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 39.9 t-80 -63.68 -42.05 98.08 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.466 HG22 ' ND2' ' A' ' 46' ' ' ASN . 35.7 m -60.03 -46.25 90.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.36 -33.33 69.47 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 t -66.83 -37.9 85.4 Favored 'General case' 0 CA--C 1.48 -1.719 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.71 -39.46 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.871 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.466 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -62.56 -32.57 73.56 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -178.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -94.01 -44.35 8.09 Favored 'General case' 0 CA--C 1.509 -0.614 0 C-N-CA 119.65 -0.82 . . . . 0.0 108.938 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.1 -40.12 62.23 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.85 69.82 9.32 Favored Pre-proline 0 C--N 1.349 0.58 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -177.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 C--O 1.262 1.718 0 C-N-CA 122.546 2.164 . . . . 0.0 112.48 179.535 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 121.023 0.439 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -152.98 145.09 23.82 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.5 m -79.33 129.61 71.6 Favored Pre-proline 0 N--CA 1.439 -1.012 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -63.0 -62.17 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.343 2.029 . . . . 0.0 112.441 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.0 t70 -161.93 -133.56 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.99 -30.69 0.02 OUTLIER Glycine 0 C--N 1.342 0.885 0 N-CA-C 107.354 -2.298 . . . . 0.0 107.354 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 m -99.63 -33.42 10.63 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.64 82.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.552 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.22 -25.27 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -24.14 67.65 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.6 -41.72 53.76 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.27 -44.9 84.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.59 -38.83 70.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.98 -52.41 65.89 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.7 m -70.74 -27.11 63.71 Favored 'General case' 0 CA--C 1.49 -1.337 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.423 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.5 t80 -61.85 -48.6 79.82 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.2 p -62.87 -38.4 90.72 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.12 -30.82 71.79 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.645 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -74.4 -49.52 22.26 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.3 mmmt -58.16 -37.95 75.67 Favored 'General case' 0 CA--C 1.491 -1.321 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.2 t -64.1 -34.98 79.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 18.1 t -66.6 -39.22 88.28 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.97 -23.12 63.12 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.9 mmt -86.08 -16.13 39.05 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -70.94 162.68 28.94 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -87.98 13.96 9.95 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.6 m -80.55 -8.83 59.73 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -87.01 78.71 8.92 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.61 -28.65 23.12 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.424 ' H ' ' HB2' ' A' ' 33' ' ' SER . 5.1 t0 -140.06 175.3 9.7 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.52 -37.64 85.46 Favored 'General case' 0 CA--C 1.505 -0.778 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 73.3 tp60 -63.0 -41.66 99.65 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.424 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.5 m -62.9 -40.69 98.34 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.14 -32.64 72.14 Favored 'General case' 0 C--N 1.351 0.66 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.423 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.4 t60 -66.06 -36.91 84.47 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -60.03 -36.31 77.0 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 74.7 m -62.71 -39.99 95.76 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -71.46 -38.87 71.26 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.55 -37.63 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -64.78 -37.16 86.67 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.2 t-80 -64.0 -42.16 97.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.456 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.9 m -60.03 -46.48 89.37 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.27 -33.39 69.72 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.7 t -66.97 -37.84 84.99 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.52 -39.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.826 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.456 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -62.55 -32.64 73.63 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.8 m -94.24 -44.37 8.0 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.961 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.9 -40.27 63.6 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.7 69.7 9.41 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--O 1.261 1.673 0 C-N-CA 122.674 2.249 . . . . 0.0 112.462 179.665 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.989 0.424 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 t -151.87 146.31 25.57 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.6 m -79.06 129.99 71.14 Favored Pre-proline 0 N--CA 1.436 -1.134 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.562 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 66.0 Cg_exo -52.2 -42.56 59.04 Favored 'Trans proline' 0 CA--C 1.498 -1.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.857 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -154.97 -133.88 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.6 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 107.369 -2.293 . . . . 0.0 107.369 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.1 m -100.25 -34.45 10.0 Favored 'General case' 0 CA--C 1.49 -1.339 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.32 -36.48 82.31 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 179.584 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.549 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.41 -24.89 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.48 -24.94 68.04 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -74.99 -41.98 58.44 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 179.519 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -57.26 -44.93 84.37 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -70.94 -38.88 72.87 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.91 -52.61 64.99 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -178.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.2 m -70.77 -27.17 63.73 Favored 'General case' 0 CA--C 1.49 -1.336 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.45 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.4 t80 -61.88 -48.67 79.45 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.7 p -62.77 -37.89 88.43 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.49 -31.24 72.21 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.9 t80 -74.62 -48.33 27.08 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.7 mmmt -58.76 -37.58 76.56 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -65.11 -28.24 69.3 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 9.5 t -71.54 -38.54 71.02 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -70.69 -23.5 62.49 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.0 mmt -81.76 -17.57 47.24 Favored 'General case' 0 CA--C 1.49 -1.353 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.8 m -69.72 163.78 24.93 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -84.11 7.21 19.52 Favored 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -81.2 -10.8 59.56 Favored 'General case' 0 CA--C 1.495 -1.154 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.32 71.64 8.15 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -109.44 -33.99 6.66 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -111.06 153.02 26.23 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.703 -1.591 . . . . 0.0 106.703 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.35 -39.44 92.36 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.34 -42.42 83.56 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.5 t -62.76 -42.58 99.75 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.23 -30.09 68.17 Favored 'General case' 0 C--N 1.349 0.544 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -65.72 -35.46 80.8 Favored 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.03 -35.24 74.67 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 76.5 m -62.31 -40.22 95.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.6 t60 -71.55 -38.82 70.96 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.17 -37.85 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 1.4 mtpp -65.08 -37.11 86.45 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.3 t-80 -64.09 -41.65 97.22 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.457 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.8 m -60.28 -46.49 89.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.26 -33.53 69.88 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.3 t -66.76 -37.86 85.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.58 -39.27 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.872 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.457 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.5 m-20 -62.64 -32.31 73.33 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.4 m -93.9 -44.71 7.96 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.869 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.91 -40.26 63.56 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.62 69.93 9.52 Favored Pre-proline 0 C--N 1.349 0.564 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 C--O 1.263 1.731 0 C-N-CA 122.685 2.256 . . . . 0.0 112.439 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 120.97 0.414 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -153.46 146.07 24.19 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.2 m -78.73 129.13 74.85 Favored Pre-proline 0 N--CA 1.438 -1.039 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -64.03 -62.86 0.09 OUTLIER 'Trans proline' 0 CA--C 1.496 -1.384 0 C-N-CA 122.312 2.008 . . . . 0.0 112.514 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.8 t70 -162.4 -133.76 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.87 -30.32 0.02 OUTLIER Glycine 0 C--N 1.341 0.837 0 N-CA-C 107.335 -2.306 . . . . 0.0 107.335 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.8 m -99.86 -33.31 10.6 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.635 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.04 -36.36 81.37 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.548 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.43 -24.96 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.52 -24.7 67.93 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.21 -42.0 56.5 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.9 mmt180 -57.08 -44.87 83.53 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -71.3 -38.93 71.75 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.93 -52.45 65.7 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.8 m -71.05 -26.77 63.22 Favored 'General case' 0 CA--C 1.49 -1.334 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.447 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.0 t80 -62.08 -48.61 79.42 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -62.85 -38.15 89.66 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.46 -30.5 71.29 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.635 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.1 t80 -75.0 -49.07 21.07 Favored 'General case' 0 N--CA 1.433 -1.294 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.0 mmmt -58.44 -37.64 75.85 Favored 'General case' 0 CA--C 1.488 -1.407 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.1 t -63.35 -35.3 79.94 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.5 t -66.39 -38.81 88.36 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -70.45 -23.08 62.64 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.4 mmt -83.76 -16.9 43.01 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -70.38 163.42 26.68 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -83.76 9.17 12.49 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.6 m -80.21 -11.91 59.69 Favored 'General case' 0 CA--C 1.492 -1.271 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.1 t -88.05 68.14 9.09 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -102.78 -29.12 11.67 Favored 'General case' 0 CA--C 1.496 -1.122 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.6 163.47 16.76 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -70.68 -39.85 73.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -67.38 -41.27 85.31 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.5 m -62.32 -40.63 96.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -30.95 66.53 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -66.57 -35.96 81.48 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -59.76 -35.49 74.71 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 74.6 m -62.08 -40.37 95.58 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -71.95 -38.69 69.75 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.92 -37.91 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.7 mtpt -64.85 -37.31 87.18 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.7 t-80 -64.13 -41.91 97.02 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.462 HG22 ' ND2' ' A' ' 46' ' ' ASN . 37.7 m -60.27 -46.59 89.3 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.22 -33.61 70.04 Favored 'General case' 0 C--N 1.343 0.304 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 t -66.94 -37.82 85.02 Favored 'General case' 0 CA--C 1.483 -1.617 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.69 -39.32 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.758 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.462 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.0 m-20 -62.5 -32.48 73.4 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.9 m -93.93 -44.73 7.94 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.647 -0.821 . . . . 0.0 108.965 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.07 -40.27 62.22 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.635 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.52 69.99 9.61 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.723 0 C-N-CA 122.687 2.258 . . . . 0.0 112.389 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 121.048 0.452 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 t -153.02 145.42 24.06 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.1 m -78.46 128.77 76.71 Favored Pre-proline 0 N--CA 1.437 -1.079 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.94 -62.0 0.11 Allowed 'Trans proline' 0 CA--C 1.497 -1.368 0 C-N-CA 122.296 1.997 . . . . 0.0 112.559 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 15.3 t70 -162.47 -133.79 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.577 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.4 -30.87 0.02 OUTLIER Glycine 0 C--N 1.343 0.944 0 N-CA-C 107.228 -2.349 . . . . 0.0 107.228 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.2 m -99.55 -33.33 10.69 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.29 -36.62 82.65 Favored 'General case' 0 N--CA 1.427 -1.621 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.632 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.64 -26.1 27.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.69 -24.14 67.66 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.49 -41.89 54.3 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.39 -44.99 84.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -71.93 -38.49 69.85 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.43 -52.42 65.7 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -71.38 -26.65 62.88 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 -178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.615 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 55.4 t80 -63.05 -47.21 83.96 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.8 p -62.6 -38.14 89.0 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -65.79 -31.29 72.18 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.465 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.599 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.6 t80 -74.26 -47.28 36.11 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.615 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -58.13 -38.2 76.07 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.8 m -67.5 -27.57 67.1 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.9 t -71.2 -38.78 72.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -71.23 -22.93 61.93 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.5 mmt -82.8 -17.74 42.99 Favored 'General case' 0 CA--C 1.493 -1.221 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -70.47 161.35 30.73 Favored 'General case' 0 CA--C 1.502 -0.904 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -88.79 13.24 12.96 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.3 m -81.72 -8.91 59.75 Favored 'General case' 0 CA--C 1.488 -1.427 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 t -87.17 79.13 8.7 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -86.77 -28.73 22.82 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -138.93 175.28 9.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.75 -37.39 84.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -63.02 -41.0 99.44 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m -61.95 -41.53 98.08 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.41 -30.45 67.33 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.79 -37.72 87.04 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -60.41 -37.37 80.61 Favored 'General case' 0 CA--C 1.495 -1.162 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 70.1 m -63.06 -39.63 95.3 Favored 'General case' 0 CA--C 1.495 -1.168 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -70.95 -38.94 72.86 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.4 t -65.77 -38.27 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.6 mtpt -65.26 -37.77 88.24 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.599 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.9 t-80 -63.84 -42.06 97.69 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.3 m -60.06 -46.18 90.42 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -71.01 -33.43 70.36 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.9 t -66.88 -38.09 85.64 Favored 'General case' 0 CA--C 1.482 -1.645 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -75.76 -39.52 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.81 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -179.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.7 m-20 -63.47 -31.5 72.68 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 85.3 m -91.9 -46.89 7.61 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.728 -0.789 . . . . 0.0 108.891 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.34 -40.27 60.76 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 70.19 11.57 Favored Pre-proline 0 C--N 1.351 0.643 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -177.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 C--O 1.263 1.774 0 C-N-CA 122.564 2.176 . . . . 0.0 112.373 179.487 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 121.082 0.467 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m -131.91 148.02 52.51 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.8 m -79.57 129.49 71.3 Favored Pre-proline 0 N--CA 1.44 -0.945 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -64.02 -62.61 0.09 OUTLIER 'Trans proline' 0 CA--C 1.498 -1.302 0 C-N-CA 122.415 2.077 . . . . 0.0 112.416 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -162.78 -133.7 0.02 OUTLIER 'General case' 0 N--CA 1.427 -1.578 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.82 -30.27 0.02 OUTLIER Glycine 0 C--N 1.341 0.831 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.5 m -99.66 -33.51 10.58 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.631 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.1 -36.35 81.46 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.551 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.0 p -70.24 -25.4 27.3 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -63.77 -24.59 67.83 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.05 -42.06 57.83 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 179.481 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -57.22 -44.9 84.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.48 -38.55 71.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.71 -52.89 63.79 Favored 'General case' 0 C--O 1.219 -0.537 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 89.1 m -70.71 -27.7 64.18 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.502 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.4 t80 -61.42 -48.92 78.99 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.3 -37.36 86.95 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.452 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -64.76 -28.6 69.69 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.605 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.7 t80 -81.02 -47.24 13.87 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.0 mmmt -58.31 -30.31 66.57 Favored 'General case' 0 CA--C 1.48 -1.742 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.44 -35.29 71.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.0 t -69.57 -42.06 75.01 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -64.74 -25.19 67.82 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.5 mmt -84.86 -21.07 29.92 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.7 m -77.5 167.3 21.86 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -87.9 6.48 35.41 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.0 m -80.76 -12.23 59.49 Favored 'General case' 0 CA--C 1.494 -1.193 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.8 t -93.46 66.81 3.94 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -111.47 -32.78 6.59 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.91 146.66 28.35 Favored 'General case' 0 CA--C 1.488 -1.417 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.56 -38.72 91.99 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 107.769 -1.196 . . . . 0.0 107.769 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -66.84 -44.93 79.8 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.7 m -62.56 -43.13 99.57 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.1 m -65.66 -38.18 88.6 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.506 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.6 t60 -64.44 -38.7 91.93 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -59.74 -39.79 85.92 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -66.02 -37.06 84.94 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.4 t60 -70.12 -37.92 75.45 Favored 'General case' 0 CA--C 1.498 -1.03 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 35' ' ' HIS . 53.6 t -67.13 -37.39 79.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.7 mttt -64.42 -37.44 87.52 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 32.7 t-80 -63.99 -42.31 97.25 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.472 HG22 ' ND2' ' A' ' 46' ' ' ASN . 41.7 m -60.0 -46.34 89.81 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -70.73 -33.45 70.86 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 40' ' ' LYS . 32.2 t -66.54 -37.98 86.14 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.34 -39.28 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.816 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.472 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.8 m-20 -63.24 -31.99 73.27 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.0 m -93.53 -44.95 7.97 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.887 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.99 -39.97 63.02 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.609 -1.397 . . . . 0.0 109.609 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.631 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.01 69.71 9.94 Favored Pre-proline 0 C--N 1.351 0.645 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 C--O 1.26 1.609 0 C-N-CA 122.596 2.198 . . . . 0.0 112.436 179.539 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.052 0.453 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 95.1 p -155.5 160.2 40.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.9 m -81.44 129.38 66.33 Favored Pre-proline 0 N--CA 1.438 -1.031 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -62.36 -61.42 0.15 Allowed 'Trans proline' 0 CA--C 1.496 -1.379 0 C-N-CA 122.379 2.053 . . . . 0.0 112.48 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -161.98 -134.03 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.633 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.54 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.36 -2.296 . . . . 0.0 107.36 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.2 m -99.74 -33.55 10.54 Favored 'General case' 0 CA--C 1.49 -1.332 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.27 -36.79 83.16 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.643 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.1 p -69.81 -25.25 27.9 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.592 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.97 -24.62 67.79 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.1 -1.445 . . . . 0.0 107.1 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.22 -42.1 56.23 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 179.521 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.3 mmt180 -57.31 -44.96 84.61 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.1 t60 -71.1 -39.3 72.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.68 -52.19 66.72 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.7 m -71.1 -26.83 63.21 Favored 'General case' 0 CA--C 1.492 -1.288 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.608 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 56.0 t80 -62.8 -47.03 85.2 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.7 p -62.83 -38.42 90.7 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.9 mptt -64.74 -31.65 72.98 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.622 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 9.8 t80 -73.93 -48.44 30.6 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.608 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.15 -37.76 72.53 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 t -64.55 -35.56 81.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.7 t -67.03 -38.38 85.78 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -70.23 -22.71 62.88 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.4 mmt -86.22 -15.93 39.32 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -71.26 162.24 29.76 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.3 13.18 12.13 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.9 m -80.76 -9.01 59.84 Favored 'General case' 0 CA--C 1.485 -1.548 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -87.79 79.77 8.06 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -86.91 -29.56 22.03 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.7 t0 -139.49 176.32 8.82 Favored 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -66.13 -38.14 87.43 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.39 -40.84 98.33 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.451 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.0 m -62.1 -41.33 98.1 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -70.31 -30.26 67.2 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.9 t60 -65.74 -37.52 86.61 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -60.37 -37.41 80.67 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.8 m -63.03 -39.72 95.6 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -71.35 -38.51 71.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.8 t -65.54 -38.28 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 11.9 mtpt -65.05 -37.43 87.56 Favored 'General case' 0 CA--C 1.488 -1.414 0 N-CA-C 106.471 -1.677 . . . . 0.0 106.471 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.622 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.2 t-80 -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.468 HG22 ' ND2' ' A' ' 46' ' ' ASN . 36.6 m -60.18 -45.98 91.28 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -179.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -70.45 -33.87 71.79 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 35.5 t -66.8 -38.69 86.99 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.12 -39.47 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.851 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -178.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.468 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.53 -30.62 71.71 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.1 m -92.45 -46.49 7.63 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 119.652 -0.819 . . . . 0.0 108.961 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.53 -39.75 55.64 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 -177.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.47 69.85 11.5 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -177.646 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo . . . . . 0 C--O 1.263 1.736 0 C-N-CA 122.503 2.135 . . . . 0.0 112.328 179.537 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 121.033 0.444 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.6 t -152.84 145.57 24.32 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.5 m -79.37 129.48 71.95 Favored Pre-proline 0 N--CA 1.437 -1.102 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -62.65 -61.79 0.13 Allowed 'Trans proline' 0 CA--C 1.497 -1.364 0 C-N-CA 122.379 2.053 . . . . 0.0 112.417 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -161.33 -134.05 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.94 0.02 OUTLIER Glycine 0 C--N 1.341 0.853 0 N-CA-C 107.312 -2.315 . . . . 0.0 107.312 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.3 m -99.76 -33.59 10.51 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.632 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.14 -36.51 82.03 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 179.671 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.557 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.6 p -70.53 -25.11 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.64 -24.57 67.84 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.26 -42.06 55.92 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -57.18 -44.83 83.93 Favored 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -71.69 -39.1 70.45 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -58.8 -52.18 66.8 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.9 m -70.92 -27.37 63.72 Favored 'General case' 0 CA--C 1.489 -1.395 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.622 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 53.1 t80 -62.54 -47.19 84.97 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.0 p -63.06 -38.05 89.65 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.22 -31.61 72.86 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.624 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 8.9 t80 -73.94 -47.85 34.68 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.1 OUTLIER -57.32 -37.24 72.2 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -64.02 -36.78 85.1 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 9.1 t -67.61 -37.16 82.12 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 -179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -69.32 -24.42 63.92 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.0 mmt -86.15 -16.17 38.73 Favored 'General case' 0 CA--C 1.493 -1.231 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.4 m -68.11 161.5 26.75 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.17 2.34 24.64 Favored 'General case' 0 CA--C 1.504 -0.825 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.9 m -80.52 -11.77 59.62 Favored 'General case' 0 CA--C 1.493 -1.226 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.2 t -91.15 69.15 6.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -114.34 -33.55 5.59 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.52 154.45 20.85 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.94 -39.51 90.54 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -68.02 -43.59 78.46 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.1 m -63.03 -41.69 99.58 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.8 m -67.7 -36.07 79.96 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.428 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.5 t60 -63.55 -36.42 83.74 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -59.74 -36.21 76.15 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 72.7 m -62.3 -39.96 94.71 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -72.17 -38.45 69.13 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -64.99 -38.11 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.997 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.5 mtpt -64.72 -37.57 88.03 Favored 'General case' 0 CA--C 1.486 -1.485 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.624 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 40.0 t-80 -64.31 -41.72 96.69 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 40.9 m -60.35 -46.47 89.83 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.02 -33.57 70.48 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 32.2 t -66.85 -37.94 85.41 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.41 -39.37 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.833 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.6 m-20 -62.59 -32.21 73.17 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -93.97 -44.84 7.87 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 119.621 -0.831 . . . . 0.0 108.997 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.09 -40.25 62.11 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.15 69.85 9.86 Favored Pre-proline 0 C--N 1.35 0.619 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 -177.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 C--O 1.262 1.687 0 C-N-CA 122.686 2.258 . . . . 0.0 112.409 179.675 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.035 0.445 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.1 t -152.63 147.01 25.64 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.9 m -78.0 130.48 72.61 Favored Pre-proline 0 N--CA 1.438 -1.032 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.552 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 68.3 Cg_exo -52.35 -42.55 59.92 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.556 2.171 . . . . 0.0 112.853 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -155.73 -134.09 0.04 OUTLIER 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.76 -31.33 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 107.41 -2.276 . . . . 0.0 107.41 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.9 m -100.37 -34.37 9.99 Favored 'General case' 0 CA--C 1.489 -1.369 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.626 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.42 -36.11 81.35 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.55 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.7 p -70.8 -25.22 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -63.46 -24.78 67.97 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.0 -42.22 57.9 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 25.9 mmt180 -57.11 -44.95 83.73 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -70.96 -38.46 72.8 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -58.7 -53.24 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.6 -27.62 64.23 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.732 -1.211 . . . . 0.0 107.732 -178.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.503 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 42.7 t80 -61.46 -48.91 78.97 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 66.6 p -63.29 -37.34 86.86 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.02 -28.2 69.33 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.2 t80 -81.55 -46.78 13.96 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.503 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 22.3 mmmt -58.39 -30.51 66.88 Favored 'General case' 0 CA--C 1.478 -1.825 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -58.32 -35.03 71.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -69.86 -41.88 74.25 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -64.88 -26.91 68.52 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.27 -23.41 35.29 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.0 m -76.38 169.78 17.59 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.75 9.82 25.78 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.6 m -79.82 -11.4 59.83 Favored 'General case' 0 CA--C 1.492 -1.265 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.07 63.37 3.7 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -102.15 -33.0 9.83 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -110.92 149.47 30.59 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 35' ' ' HIS . 98.9 mt-10 -65.72 -38.44 89.16 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -67.06 -43.13 83.45 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.9 m -62.36 -42.42 99.39 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -70.29 -32.15 69.8 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.514 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.7 t60 -65.29 -38.53 90.52 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -60.06 -39.28 85.45 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 55.9 m -66.22 -37.17 84.9 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -70.15 -38.04 75.37 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 35' ' ' HIS . 52.9 t -66.99 -37.54 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.128 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.432 ' O ' ' N ' ' A' ' 44' ' ' CYS . 10.4 mttt -64.58 -37.24 86.87 Favored 'General case' 0 CA--C 1.486 -1.491 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.586 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.5 t-80 -63.9 -41.74 97.62 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.437 HG22 ' ND2' ' A' ' 46' ' ' ASN . 38.2 m -60.41 -46.38 90.22 Favored 'General case' 0 N--CA 1.436 -1.125 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.04 -33.34 70.21 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 40' ' ' LYS . 31.5 t -66.38 -38.08 86.73 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.22 -39.37 35.19 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.941 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.437 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -63.49 -31.44 72.6 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 87.7 m -92.93 -45.4 7.98 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.868 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.28 -40.06 61.34 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.626 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -148.47 69.86 10.5 Favored Pre-proline 0 C--N 1.349 0.565 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.261 1.672 0 C-N-CA 122.67 2.246 . . . . 0.0 112.46 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 120.983 0.42 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -153.52 145.42 23.56 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -78.11 129.47 75.47 Favored Pre-proline 0 N--CA 1.438 -1.025 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -63.81 -62.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.497 -1.348 0 C-N-CA 122.332 2.021 . . . . 0.0 112.508 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 14.1 t70 -162.01 -134.28 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -167.93 -30.98 0.02 OUTLIER Glycine 0 C--N 1.342 0.869 0 N-CA-C 107.34 -2.304 . . . . 0.0 107.34 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.9 m -99.51 -33.41 10.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.2 -36.34 81.64 Favored 'General case' 0 N--CA 1.428 -1.575 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 179.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.555 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.4 p -70.56 -25.09 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.587 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.59 -24.56 67.85 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.47 -42.15 53.85 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 179.556 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.42 -44.99 85.09 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.96 -39.22 72.69 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.99 -52.44 65.77 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.2 m -71.16 -26.65 63.07 Favored 'General case' 0 CA--C 1.49 -1.327 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -178.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.453 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.7 t80 -61.99 -48.67 79.29 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 65.4 p -62.83 -37.99 88.95 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.85 -30.53 71.16 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.3 t80 -74.86 -48.66 23.82 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.2 mmmt -58.97 -37.77 77.55 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.7 m -65.38 -28.56 69.35 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.8 t -71.5 -39.01 71.11 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -71.43 -22.84 61.79 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.2 mmt -84.33 -16.94 41.17 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -70.81 163.91 26.32 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -87.1 19.86 2.94 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.2 m -90.82 -6.98 53.56 Favored 'General case' 0 CA--C 1.478 -1.797 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.88 75.56 8.06 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 106.503 -1.665 . . . . 0.0 106.503 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -89.84 -32.63 16.82 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -136.25 174.46 10.59 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' HIS . 99.2 mt-10 -67.2 -37.07 83.04 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.52 -43.12 98.09 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.8 m -62.97 -41.39 99.52 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 92.0 m -66.68 -36.26 82.1 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 39' ' ' VAL . 81.2 t60 -63.43 -37.26 86.59 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -59.93 -38.14 81.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 68.7 m -63.13 -39.62 95.22 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -70.49 -38.51 74.37 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.9 t -65.59 -37.65 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.75 -37.35 87.32 Favored 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 42.3 t-80 -64.2 -42.1 96.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.45 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.1 m -60.19 -46.43 89.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -70.9 -34.03 71.16 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.75 -38.43 86.62 Favored 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -75.64 -39.36 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.763 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.45 ' ND2' HG22 ' A' ' 42' ' ' THR . 62.8 m-20 -63.28 -31.58 72.76 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -178.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.6 m -91.51 -47.17 7.57 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.904 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.27 -40.12 61.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -147.54 70.19 11.51 Favored Pre-proline 0 C--N 1.35 0.614 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -177.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.631 2.221 . . . . 0.0 112.383 179.557 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.976 0.417 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 t -152.81 146.5 25.11 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.1 m -78.39 130.81 70.46 Favored Pre-proline 0 N--CA 1.437 -1.095 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.549 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 72.1 Cg_exo -52.06 -42.62 57.86 Favored 'Trans proline' 0 CA--C 1.497 -1.35 0 C-N-CA 122.633 2.222 . . . . 0.0 112.795 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -154.93 -138.63 0.07 Allowed 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -159.29 -31.17 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 -179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 m -100.0 -34.41 10.1 Favored 'General case' 0 CA--C 1.491 -1.297 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.86 -35.99 81.8 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.607 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.2 p -70.47 -24.68 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.51 -24.67 67.92 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.27 -42.13 55.68 Favored 'General case' 0 CA--C 1.495 -1.146 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.44 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 26.8 mmt180 -57.26 -44.85 84.28 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -71.1 -38.99 72.35 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.96 -52.44 65.75 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 84.5 m -70.92 -26.87 63.39 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 49.0 t80 -62.0 -48.54 79.85 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 69.3 p -62.79 -37.96 88.77 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.89 -30.24 70.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.631 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 5.7 t80 -75.09 -48.66 22.76 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.5 mmmt -58.68 -37.41 75.99 Favored 'General case' 0 CA--C 1.489 -1.382 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 74.4 m -64.85 -32.88 74.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.5 t -68.83 -39.05 80.2 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -70.94 -21.37 62.36 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 14.5 mtm -89.13 -5.52 57.71 Favored 'General case' 0 CA--C 1.487 -1.442 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.1 m -79.98 164.82 23.17 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.04 13.03 13.92 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.9 m -82.28 -8.37 59.64 Favored 'General case' 0 CA--C 1.487 -1.455 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.5 t -86.84 79.03 8.93 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -87.28 -29.36 21.69 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' H ' ' HB2' ' A' ' 33' ' ' SER . 4.9 t0 -139.28 175.49 9.52 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -66.47 -38.01 86.38 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 70.1 m -62.16 -41.04 97.91 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -70.28 -30.88 68.0 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.443 ' O ' HG23 ' A' ' 39' ' ' VAL . 80.3 t60 -66.09 -36.9 84.4 Favored 'General case' 0 CA--C 1.501 -0.918 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -60.05 -36.99 78.52 Favored 'General case' 0 CA--C 1.495 -1.173 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 73.3 m -62.87 -39.84 95.66 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.6 t60 -71.13 -38.76 72.28 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.1 t -65.38 -37.98 81.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.077 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' CYS . 12.4 mtpt -65.05 -37.17 86.71 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.631 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 41.5 t-80 -64.02 -41.82 97.31 Favored 'General case' 0 CA--C 1.497 -1.063 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' ND2' ' A' ' 46' ' ' ASN . 34.3 m -60.31 -46.31 90.34 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -71.13 -33.89 70.52 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.4 t -66.61 -37.98 86.0 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.9 t -76.28 -39.24 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.455 ' ND2' HG22 ' A' ' 42' ' ' THR . 60.0 m-20 -62.57 -32.18 73.11 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -178.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.3 m -94.05 -44.71 7.91 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.88 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.93 -40.26 63.32 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.644 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.36 69.72 9.67 Favored Pre-proline 0 C--N 1.349 0.583 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 C--O 1.262 1.72 0 C-N-CA 122.638 2.225 . . . . 0.0 112.414 179.601 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.494 1.743 0 CA-C-O 121.01 0.433 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.1 p -155.03 160.97 41.44 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.9 m -82.16 130.0 61.69 Favored Pre-proline 0 N--CA 1.437 -1.077 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.567 ' HG2' ' CH2' ' A' ' 8' ' ' TRP . 69.6 Cg_exo -52.21 -42.49 59.48 Favored 'Trans proline' 0 CA--C 1.498 -1.29 0 C-N-CA 122.621 2.214 . . . . 0.0 112.773 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -154.61 -134.72 0.05 OUTLIER 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.66 -31.53 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 107.414 -2.274 . . . . 0.0 107.414 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -100.2 -34.7 9.91 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.66 -36.42 82.8 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.554 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 14.3 p -70.29 -25.35 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -63.54 -24.44 67.81 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.2 -42.3 55.93 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.554 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -57.17 -44.86 83.9 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.88 -39.31 72.9 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -58.92 -52.24 66.59 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 86.2 m -70.97 -26.85 63.33 Favored 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.469 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -62.14 -48.44 80.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 72.4 p -62.72 -38.27 89.83 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.28 -31.28 72.34 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 179.597 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.644 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.5 t80 -73.99 -49.16 25.68 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.469 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 21.4 mmmt -58.07 -37.16 73.94 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.3 t -63.48 -37.11 86.03 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 12.9 t -67.18 -37.34 83.54 Favored 'General case' 0 C--N 1.348 0.526 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.8 mm100 -69.81 -19.95 63.47 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 13.9 mtm -90.37 -3.15 57.91 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.5 p -73.9 166.57 23.11 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -86.46 1.53 51.09 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.8 m -87.37 -8.2 56.87 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.9 t -87.48 65.56 8.67 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.757 -1.572 . . . . 0.0 106.757 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.8 p80 -114.51 -30.91 6.39 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -104.04 149.83 24.82 Favored 'General case' 0 CA--C 1.49 -1.333 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -64.77 -39.14 93.11 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -67.42 -44.35 79.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.6 m -62.52 -42.5 99.55 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 86.6 m -67.29 -36.36 81.38 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.7 t60 -63.27 -36.33 83.3 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.58 -36.19 75.75 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 69.8 m -62.29 -40.08 95.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 -179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -71.6 -38.84 70.82 Favored 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 35' ' ' HIS . 55.6 t -65.3 -37.57 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -64.45 -37.62 88.16 Favored 'General case' 0 CA--C 1.486 -1.482 0 N-CA-C 106.533 -1.655 . . . . 0.0 106.533 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 43.1 t-80 -64.2 -42.2 96.75 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.464 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.8 m -60.22 -46.54 89.39 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -70.92 -33.86 70.95 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.7 t -66.99 -37.99 85.22 Favored 'General case' 0 CA--C 1.481 -1.708 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.03 -39.48 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.844 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.2 m-20 -62.79 -31.84 72.89 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -178.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.6 m -93.6 -45.36 7.76 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.672 -0.811 . . . . 0.0 108.949 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.12 -40.25 61.93 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.643 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -148.96 69.17 9.87 Favored Pre-proline 0 C--N 1.349 0.567 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.882 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo . . . . . 0 C--O 1.261 1.644 0 C-N-CA 122.858 2.372 . . . . 0.0 112.698 179.587 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 120.997 0.427 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 t -153.16 145.3 23.81 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 79.8 m -79.23 129.16 73.41 Favored Pre-proline 0 N--CA 1.437 -1.103 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.85 -62.71 0.1 Allowed 'Trans proline' 0 CA--C 1.497 -1.361 0 C-N-CA 122.366 2.044 . . . . 0.0 112.518 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -161.47 -133.8 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.647 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.65 -30.63 0.02 OUTLIER Glycine 0 C--N 1.341 0.825 0 N-CA-C 107.295 -2.322 . . . . 0.0 107.295 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.1 m -99.77 -33.58 10.52 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.62 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.15 -36.61 82.33 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.632 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.556 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.59 -25.55 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.552 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -63.72 -24.34 67.73 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.21 -41.87 56.74 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 179.522 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -57.05 -44.82 83.36 Favored 'General case' 0 N--CA 1.428 -1.544 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.45 -38.78 71.28 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.02 -52.4 65.94 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 87.0 m -70.77 -27.09 63.67 Favored 'General case' 0 CA--C 1.49 -1.359 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 -178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.44 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 47.1 t80 -61.8 -48.73 79.31 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 70.3 p -62.76 -38.04 89.0 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.443 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.25 -31.09 72.06 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.8 t80 -74.42 -48.74 25.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.4 mmmt -58.4 -36.46 73.6 Favored 'General case' 0 CA--C 1.491 -1.312 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 75.1 m -64.12 -34.74 78.75 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 10.8 t -69.84 -37.39 76.16 Favored 'General case' 0 C--N 1.349 0.562 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -68.15 -24.85 65.03 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 73.4 mtm -93.41 -2.85 54.17 Favored 'General case' 0 CA--C 1.487 -1.468 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -78.86 163.43 25.3 Favored 'General case' 0 CA--C 1.497 -1.073 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.18 14.06 13.53 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.4 m -82.73 -7.34 59.66 Favored 'General case' 0 CA--C 1.487 -1.46 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 48.7 t -86.33 78.64 9.26 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -87.94 -27.55 22.06 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.441 ' H ' ' HB2' ' A' ' 33' ' ' SER . 3.6 t0 -139.1 173.99 10.98 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -66.69 -37.93 85.74 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -63.42 -40.63 97.71 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.441 ' HB2' ' H ' ' A' ' 30' ' ' ASP . 71.0 m -61.73 -41.12 97.23 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -33.47 72.98 Favored 'General case' 0 C--N 1.352 0.692 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.431 ' O ' HG23 ' A' ' 39' ' ' VAL . 79.0 t60 -65.34 -37.2 86.35 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -60.14 -36.35 77.32 Favored 'General case' 0 CA--C 1.494 -1.177 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 77.2 m -62.24 -40.18 95.31 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -71.62 -39.12 70.67 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 35' ' ' HIS . 56.0 t -65.09 -37.45 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.62 -37.61 88.15 Favored 'General case' 0 CA--C 1.486 -1.488 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.632 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 44.3 t-80 -64.55 -41.85 96.08 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.463 HG22 ' ND2' ' A' ' 46' ' ' ASN . 39.8 m -60.31 -46.81 88.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -71.41 -33.21 69.24 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 t -67.14 -37.84 84.51 Favored 'General case' 0 CA--C 1.481 -1.694 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.0 t -76.69 -39.5 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.463 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.4 m-20 -62.61 -32.37 73.38 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 86.9 m -94.11 -44.63 7.92 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 119.628 -0.829 . . . . 0.0 108.861 -178.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.88 -40.37 63.8 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.62 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.5 OUTLIER -149.76 69.95 9.41 Favored Pre-proline 0 C--N 1.35 0.589 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.712 0 C-N-CA 122.648 2.232 . . . . 0.0 112.444 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.063 0.458 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -131.55 147.49 52.54 Favored 'General case' 0 CA--C 1.497 -1.085 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.7 m -80.5 129.34 69.26 Favored Pre-proline 0 N--CA 1.438 -1.049 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.76 -62.19 0.12 Allowed 'Trans proline' 0 CA--C 1.497 -1.373 0 C-N-CA 122.344 2.029 . . . . 0.0 112.461 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -161.36 -133.64 0.03 OUTLIER 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.85 -30.8 0.02 OUTLIER Glycine 0 C--N 1.342 0.864 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.5 m -99.62 -33.61 10.55 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.629 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.19 -36.69 82.65 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.7 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.559 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.37 -25.14 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.97 -24.27 67.66 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.1 OUTLIER -75.48 -42.17 53.63 Favored 'General case' 0 CA--C 1.497 -1.07 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 179.471 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -57.38 -44.81 84.75 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -71.31 -39.72 71.26 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.91 -51.81 68.43 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 85.2 m -70.15 -29.79 66.78 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.493 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 41.5 t80 -61.42 -49.29 77.46 Favored 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 61.9 p -63.44 -38.24 90.37 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -63.45 -29.31 70.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.591 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 6.6 t80 -80.38 -47.38 14.51 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 23.4 mmmt -58.02 -30.57 66.22 Favored 'General case' 0 CA--C 1.48 -1.731 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.7 t -58.45 -35.4 72.06 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 40.1 t -69.45 -41.99 75.51 Favored 'General case' 0 CA--C 1.505 -0.75 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.66 -25.58 68.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 -179.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 36.5 mmt -84.87 -21.21 29.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.4 m -77.37 167.03 22.37 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -87.99 6.01 38.0 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.0 m -80.13 -12.58 59.65 Favored 'General case' 0 CA--C 1.495 -1.167 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.8 t -92.67 65.28 4.27 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -110.79 -32.1 6.96 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -103.12 146.22 28.72 Favored 'General case' 0 CA--C 1.487 -1.473 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -64.73 -38.83 92.33 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -66.87 -44.96 79.58 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.2 m -62.43 -43.15 99.5 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 94.0 m -65.3 -38.57 90.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.504 ' O ' HG23 ' A' ' 39' ' ' VAL . 84.0 t60 -64.82 -38.97 92.77 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -59.73 -39.4 84.61 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 56.2 m -65.98 -37.21 85.38 Favored 'General case' 0 CA--C 1.498 -1.058 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -70.5 -37.92 74.23 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 35' ' ' HIS . 54.8 t -67.25 -37.27 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.068 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 44' ' ' CYS . 9.8 mttt -64.07 -37.4 87.31 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.591 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 33.2 t-80 -64.04 -42.55 97.04 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.476 HG22 ' ND2' ' A' ' 46' ' ' ASN . 45.7 m -60.06 -46.57 89.12 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -70.8 -33.1 70.37 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.422 ' N ' ' O ' ' A' ' 40' ' ' LYS . 34.0 t -66.49 -37.89 86.06 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.402 ' O ' ' C ' ' A' ' 49' ' ' CYS . 2.1 t -76.82 -39.62 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.921 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.476 ' ND2' HG22 ' A' ' 42' ' ' THR . 64.9 m-20 -63.01 -32.73 74.16 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 -178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 89.9 m -93.78 -44.56 8.07 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.907 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.01 -40.19 62.62 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -178.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.629 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.23 69.7 9.77 Favored Pre-proline 0 C--N 1.35 0.597 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 C--O 1.261 1.652 0 C-N-CA 122.665 2.244 . . . . 0.0 112.432 179.59 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.07 0.462 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.0 p -156.25 160.69 40.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.8 m -81.45 127.43 73.37 Favored Pre-proline 0 N--CA 1.439 -1.009 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.51 -63.63 0.06 OUTLIER 'Trans proline' 0 CA--C 1.499 -1.259 0 C-N-CA 122.402 2.068 . . . . 0.0 112.537 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -161.98 -133.79 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.628 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.55 -30.29 0.02 OUTLIER Glycine 0 C--N 1.342 0.901 0 N-CA-C 107.313 -2.315 . . . . 0.0 107.313 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -99.9 -33.43 10.53 Favored 'General case' 0 CA--C 1.491 -1.315 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -62.13 -36.27 81.27 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.553 ' HB ' ' CZ3' ' A' ' 8' ' ' TRP . 13.8 p -70.32 -25.01 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.62 -24.67 67.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -75.16 -42.07 56.8 Favored 'General case' 0 CA--C 1.496 -1.096 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 27.1 mmt180 -57.1 -44.97 83.71 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.17 -39.01 72.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -58.98 -52.34 66.16 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 88.7 m -71.09 -27.2 63.44 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.452 ' CZ ' ' HD3' ' A' ' 20' ' ' LYS . 48.2 t80 -61.94 -48.5 80.11 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.1 p -62.63 -38.12 89.01 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 -179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -65.11 -31.78 73.16 Favored 'General case' 0 CA--C 1.504 -0.803 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.637 ' HB2' ' HB2' ' A' ' 41' ' ' HIS . 7.0 t80 -73.81 -49.21 26.34 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HD3' ' CZ ' ' A' ' 16' ' ' PHE . 20.9 mmmt -58.23 -36.7 73.55 Favored 'General case' 0 CA--C 1.487 -1.457 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.5 t -62.23 -36.42 81.94 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 11.3 t -68.46 -37.69 80.42 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -68.69 -24.35 64.49 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 -179.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 35.3 mmt -85.85 -16.17 39.52 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.3 m -69.0 160.66 30.53 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -79.54 2.11 23.37 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.5 m -80.59 -10.66 59.73 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.91 69.92 5.51 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -115.37 -33.64 5.22 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -105.47 150.97 24.84 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.97 -39.05 93.26 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -67.51 -44.27 78.83 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -63.25 -41.75 99.1 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 90.9 m -67.09 -36.14 81.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 39' ' ' VAL . 78.4 t60 -63.53 -37.12 86.11 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -59.82 -35.16 74.14 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -179.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 84.7 m -62.46 -39.97 95.12 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.9 t60 -73.75 -36.53 65.13 Favored 'General case' 0 CA--C 1.498 -1.031 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 35' ' ' HIS . 51.1 t -65.82 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.02 -28.02 65.15 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 -179.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 19' ' ' TYR . 36.6 t-80 -70.75 -40.45 72.7 Favored 'General case' 0 CA--C 1.49 -1.364 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.452 HG22 ' ND2' ' A' ' 46' ' ' ASN . 32.2 m -61.18 -46.16 91.66 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -71.61 -33.55 69.08 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 33.3 t -66.52 -37.99 86.22 Favored 'General case' 0 CA--C 1.481 -1.674 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.0 t -76.53 -39.39 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.83 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -178.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.452 ' ND2' HG22 ' A' ' 42' ' ' THR . 63.6 m-20 -62.72 -32.26 73.33 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.4 m -94.03 -44.69 7.92 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.599 -0.841 . . . . 0.0 108.901 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -70.96 -40.2 63.06 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -178.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.636 ' HB2' ' CD1' ' A' ' 8' ' ' TRP . 0.6 OUTLIER -149.69 69.95 9.47 Favored Pre-proline 0 C--N 1.35 0.6 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -177.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.263 1.743 0 C-N-CA 122.636 2.224 . . . . 0.0 112.416 179.548 . . . . . . . . 1 1 . 1 stop_ save_