data_2lqh_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lqh _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 114.176 0.43 . . . . 0.0 114.176 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -67.18 -19.24 65.54 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -71.32 -10.21 59.38 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 119.765 -0.774 . . . . 0.0 113.017 -175.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -83.69 -7.12 59.55 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.762 0.791 . . . . 0.0 109.185 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -99.81 7.14 45.23 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.001 -177.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.8 p -139.54 114.67 7.96 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.526 0.679 . . . . 0.0 109.348 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.1 166.28 13.5 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -49.13 -41.61 36.69 Favored 'General case' 0 C--O 1.206 -1.224 0 C-N-CA 124.351 1.061 . . . . 0.0 111.154 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -52.06 -47.07 65.3 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.203 0.601 . . . . 0.0 111.925 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.05 -45.83 59.32 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.3 ptm180 -70.07 -42.58 72.6 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.752 -177.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.9 t -67.89 -26.74 66.15 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.584 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 8.7 t60 -70.7 -43.35 69.18 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 176.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.469 HD23 HD22 ' A' ' 68' ' ' LEU . 2.4 mp -65.36 -37.91 88.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.478 176.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -57.05 -45.43 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 173.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 12.2 t-80 -57.98 -44.97 87.41 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.58 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.584 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.1 mptp? -64.36 -38.17 90.09 Favored 'General case' 0 CA--C 1.506 -0.713 0 C-N-CA 119.977 -0.689 . . . . 0.0 112.635 177.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 19' ' ' VAL . 81.4 mt -54.75 -44.92 74.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 123.381 0.426 . . . . 0.0 109.88 176.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.437 HG12 ' HE1' ' A' ' 40' ' ' MET . 54.0 t -63.83 -48.4 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.812 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 35.4 mt-30 -60.25 -27.96 67.66 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 120.954 0.407 . . . . 0.0 111.906 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -81.21 -46.58 14.61 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.772 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.503 HD12 ' CG2' ' B' ' 145' ' ' ILE . 3.7 tt -71.35 -30.18 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.699 0.762 . . . . 0.0 110.12 -176.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -127.89 103.87 21.14 Favored Pre-proline 0 N--CA 1.409 -2.494 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.341 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.57 76.5 0.54 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.848 2.365 . . . . 0.0 110.463 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.445 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 13.0 t -60.46 126.42 84.56 Favored Pre-proline 0 N--CA 1.423 -1.807 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.976 -175.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -73.18 -29.91 11.1 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.341 2.027 . . . . 0.0 111.574 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -146.9 143.87 19.12 Favored Pre-proline 0 C--N 1.308 -1.233 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -53.74 -18.28 11.93 Favored 'Trans proline' 0 CA--C 1.557 1.634 0 C-N-CA 122.652 2.235 . . . . 0.0 114.05 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.56 -13.41 59.55 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.566 -0.709 . . . . 0.0 112.469 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.445 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -78.36 -6.53 55.43 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.452 1.12 . . . . 0.0 108.747 175.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 40' ' ' MET . 21.8 mt -89.97 7.75 35.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.383 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.448 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -132.72 18.55 4.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.817 0.818 . . . . 0.0 109.323 173.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.575 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 20.5 t70 -80.79 173.78 12.27 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.477 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.575 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -65.5 -24.98 67.27 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 121.955 -0.465 . . . . 0.0 110.901 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 33.1 ttm180 -74.9 -22.35 58.68 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.729 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.0 tpp -59.4 -45.22 92.1 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.732 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -56.3 -36.09 68.27 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.199 0.524 . . . . 0.0 109.866 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.432 ' OD1' HD22 ' B' ' 149' ' ' LEU . 5.8 t30 -76.15 -43.87 40.86 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.377 1.071 . . . . 0.0 111.372 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 78.6 mt -70.04 -40.86 74.87 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.696 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.729 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.32 -30.7 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.896 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -61.21 -49.17 78.21 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 174.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.56 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 6.8 t80 -57.96 -44.44 87.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.674 0.79 . . . . 0.0 110.215 174.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.64 87.87 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.636 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -68.82 -40.3 79.57 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 1.4 ptmt -65.44 -41.74 93.16 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.359 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.7 t -65.5 -52.7 48.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.629 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -57.78 -51.28 70.21 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.648 0.779 . . . . 0.0 110.015 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -39.18 93.33 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 123.495 0.497 . . . . 0.0 112.941 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.96 -51.63 68.46 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.442 0.639 . . . . 0.0 110.91 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.55 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 2.3 ptp -73.59 -27.59 61.38 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.321 -0.854 . . . . 0.0 113.272 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -62.03 -47.39 84.94 Favored 'General case' 0 C--O 1.2 -1.503 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -74.04 -22.62 59.49 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 t -77.54 -32.26 53.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.96 169.46 11.52 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -120.29 17.61 12.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.911 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.7 p -167.88 151.11 5.92 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.55 -33.34 73.91 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.185 -177.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -65.65 -36.96 85.19 Favored 'General case' 0 C--O 1.198 -1.615 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.285 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 9.4 tp10 -67.84 -46.45 71.76 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.63 99.25 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.762 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -48.72 78.9 Favored 'General case' 0 C--O 1.206 -1.22 0 C-N-CA 123.766 0.826 . . . . 0.0 109.054 172.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.23 -55.91 26.62 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.6 pp -64.9 -29.65 70.6 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.55 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.3 OUTLIER -76.04 -39.19 56.09 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.8 -29.12 69.94 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 123.02 0.528 . . . . 0.0 109.642 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 72.7 mm-40 -67.81 -53.04 30.11 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.291 0.637 . . . . 0.0 111.656 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.416 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -66.16 -35.65 81.03 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 119.338 -0.945 . . . . 0.0 111.46 -177.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.546 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.99 -40.24 80.69 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 26.8 t80 -52.29 -54.56 29.85 Favored 'General case' 0 C--O 1.257 1.489 0 C-N-CA 125.047 1.339 . . . . 0.0 111.416 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -67.86 -35.46 78.59 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.017 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -62.39 -39.69 85.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 O-C-N 123.424 0.453 . . . . 0.0 110.83 177.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.546 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 46.6 mt-30 -64.36 -55.62 19.88 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 123.518 0.511 . . . . 0.0 110.822 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.548 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.3 ptpt -68.0 -28.66 67.61 Favored 'General case' 0 N--CA 1.417 -2.084 0 C-N-CA 119.632 -0.827 . . . . 0.0 112.459 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 82' ' ' LYS . 13.5 tp10 -58.57 -53.16 61.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 123.639 0.587 . . . . 0.0 109.833 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -67.34 -38.94 85.65 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 123.199 0.312 . . . . 0.0 111.708 -177.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -62.73 -53.16 58.6 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.541 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.7 pt-20 -72.06 -34.32 68.65 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 120.174 -0.61 . . . . 0.0 112.307 -176.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.498 -1.034 0 C-N-CA 119.594 -0.843 . . . . 0.0 111.609 -178.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.442 -0.835 0 CA-C-O 121.067 0.46 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -72.95 -39.97 65.77 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.314 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -63.49 -43.22 97.88 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.066 0.46 . . . . 0.0 111.076 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -66.89 -36.74 82.98 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 122.721 0.408 . . . . 0.0 110.77 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 61.6 tp -56.57 -53.85 52.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.43 -45.73 90.72 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.954 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.6 m -57.02 -36.14 70.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.985 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 38.5 m -77.27 -58.42 3.28 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.231 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.32 -60.12 4.36 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.531 ' HG ' ' CD2' ' A' ' 17' ' ' HIS . 6.0 m . . . . . 0 C--N 1.308 -1.224 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.664 -171.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.597 ' O ' HG12 ' B' ' 145' ' ' ILE . 14.3 tpt . . . . . 0 C--O 1.208 -1.092 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 38.5 mt-10 -58.85 -27.28 64.99 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 24.8 t -61.57 -54.29 45.05 Favored 'General case' 0 C--O 1.249 1.066 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.587 HD12 ' SD ' ' B' ' 141' ' ' MET . 49.3 pt -66.01 -29.26 46.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.597 HG12 ' O ' ' B' ' 141' ' ' MET . 14.2 mm -64.16 -43.39 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.813 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 20.7 mtm180 -59.1 -42.51 90.65 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 48.3 m -59.94 -41.65 92.28 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.517 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 144' ' ' ILE . 28.9 mt-10 -77.2 -38.42 51.52 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.888 -0.508 . . . . 0.0 112.358 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.432 HD22 ' OD1' ' A' ' 42' ' ' ASN . 4.4 pp -75.36 -24.87 57.33 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 58.5 ttp . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -176.886 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.307 0 N-CA-C 116.081 1.193 . . . . 0.0 116.081 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 p-90 -74.03 -7.09 51.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.06 0.93 . . . . 0.0 111.079 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -55.28 -25.03 31.4 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -87.26 0.24 55.68 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.431 0.634 . . . . 0.0 111.725 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -106.7 7.05 30.27 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.711 0.767 . . . . 0.0 109.907 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.99 110.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.698 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.442 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.491 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -91.05 160.03 15.81 Favored 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -176.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -38.36 67.69 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.127 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.38 -39.16 85.62 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 120.901 0.381 . . . . 0.0 111.489 -177.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.08 -48.75 61.87 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.496 ' O ' HG21 ' A' ' 19' ' ' VAL . 4.6 ptm180 -68.3 -38.99 82.17 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.738 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.9 t -65.15 -29.85 70.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.746 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 66.2 t60 -69.64 -42.63 74.02 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.46 176.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.464 HD23 HD23 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -60.88 -38.68 86.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 15' ' ' ARG . 97.9 t -59.08 -51.04 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 121.296 0.569 . . . . 0.0 109.673 174.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -51.29 -47.88 62.44 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.576 1.15 . . . . 0.0 110.605 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.746 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 54.7 mttm -67.99 -37.86 81.98 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 86.9 mt -54.7 -42.88 72.01 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.69 -52.05 65.42 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.938 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.336 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -74.1 -14.51 60.99 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.711 -0.796 . . . . 0.0 112.936 -175.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.27 -46.27 15.02 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.757 173.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.558 HD11 ' CG2' ' B' ' 145' ' ' ILE . 5.0 tt -72.72 -28.93 28.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.618 0.723 . . . . 0.0 109.866 -177.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -132.59 92.57 26.95 Favored Pre-proline 0 N--CA 1.401 -2.894 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.216 -175.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.74 91.93 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.423 2.082 . . . . 0.0 107.928 170.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.5 123.23 78.12 Favored Pre-proline 0 N--CA 1.422 -1.872 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.893 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.03 -23.44 12.16 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.115 2.543 . . . . 0.0 111.683 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -143.87 143.04 21.62 Favored Pre-proline 0 CA--C 1.491 -1.302 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.28 -13.64 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 121.496 1.464 . . . . 0.0 110.697 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.32 -14.18 55.76 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.754 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.83 -12.14 60.31 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 122.047 0.927 . . . . 0.0 109.325 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 26.1 mt -83.98 0.61 47.32 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.464 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -133.18 19.01 4.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.91 0.862 . . . . 0.0 109.572 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.9 t70 -77.37 174.68 10.53 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.692 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -69.79 -27.41 64.88 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.327 0.585 . . . . 0.0 109.61 176.759 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 14.7 ttm180 -73.48 -21.3 60.46 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.297 0.57 . . . . 0.0 110.053 177.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.52 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -61.28 -40.34 93.74 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.491 177.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.0 pt-20 -62.56 -30.76 71.54 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 118.62 -1.232 . . . . 0.0 109.896 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.415 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -70.69 -48.5 54.39 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.71 1.204 . . . . 0.0 110.527 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.7 mt -67.92 -44.78 76.08 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.833 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.534 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 9.5 p -72.18 -32.34 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.414 -0.515 . . . . 0.0 109.93 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.62 -41.51 99.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.498 0.666 . . . . 0.0 109.319 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.507 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -60.56 -50.31 74.03 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.618 173.156 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.84 -40.57 88.96 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.989 0.423 . . . . 0.0 110.964 -177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.8 mttt -65.03 -48.27 74.46 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.301 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.535 ' CE ' ' HA ' ' B' ' 149' ' ' LEU . 15.0 pttp -63.8 -38.46 91.19 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 46' ' ' TYR . 55.2 t -64.43 -53.3 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.204 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -56.05 -46.81 78.79 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 124.09 0.869 . . . . 0.0 109.696 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.15 99.72 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.646 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -58.07 -53.27 60.1 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 123.292 0.637 . . . . 0.0 110.828 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.437 ' HB3' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.3 -32.92 74.22 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 178.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -64.66 -41.99 95.72 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 123.328 0.651 . . . . 0.0 109.56 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.43 -22.09 41.53 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.011 -0.431 . . . . 0.0 111.995 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.1 t -79.14 -54.18 6.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 160.08 14.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -171.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.59 -2.1 29.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.588 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.3 m -154.82 160.23 41.11 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -36.9 69.15 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 118.799 -1.16 . . . . 0.0 111.753 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.46 -38.14 83.22 Favored 'General case' 0 C--O 1.197 -1.66 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -47.09 77.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.299 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.09 91.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.518 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -55.98 -48.67 75.41 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 125.66 1.584 . . . . 0.0 109.12 175.167 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -61.25 -55.56 30.54 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 123.842 0.857 . . . . 0.0 111.851 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.437 HD13 ' HB3' ' A' ' 54' ' ' MET . 3.9 pp -68.61 -29.3 67.79 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 120.469 -0.493 . . . . 0.0 111.336 -175.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 0.9 OUTLIER -71.76 -40.94 69.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.516 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -59.13 -38.07 78.77 Favored 'General case' 0 C--O 1.203 -1.363 0 C-N-CA 123.463 0.705 . . . . 0.0 109.699 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 4.8 mm-40 -60.94 -50.08 74.87 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.188 0.995 . . . . 0.0 111.825 175.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.432 ' O ' HD11 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.77 -35.95 67.55 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 119.222 -0.991 . . . . 0.0 111.642 -177.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.631 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -67.93 -36.96 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.467 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.7 -54.23 40.87 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 124.976 1.311 . . . . 0.0 110.985 175.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HB3' ' HZ2' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -68.67 -32.29 72.01 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.195 -176.186 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.432 HD11 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -64.06 -43.8 97.61 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 59.8 mt-30 -63.17 -51.62 65.67 Favored 'General case' 0 CA--C 1.493 -1.241 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.903 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.1 ptpt -72.16 -27.61 62.7 Favored 'General case' 0 N--CA 1.402 -2.852 0 C-N-CA 119.048 -1.061 . . . . 0.0 112.911 -177.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -60.72 -52.87 63.26 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.669 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.1 pp -65.38 -35.67 81.67 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.97 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.75 -44.54 73.53 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -71.19 -34.77 71.21 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 121.973 -0.454 . . . . 0.0 111.479 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.494 ' NZ ' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.597 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.354 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.437 -1.094 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.36 -40.13 74.21 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.845 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' B' ' 115' ' ' LEU . 25.1 mt-30 -61.87 -36.87 82.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.742 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -61.84 -46.88 87.57 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.734 0.646 . . . . 0.0 109.731 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.71 -47.2 74.01 Favored 'General case' 0 C--O 1.249 1.042 0 O-C-N 123.751 0.657 . . . . 0.0 110.081 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.484 HD23 ' CD ' ' A' ' 21' ' ' LYS . 85.8 mt -52.87 -62.05 1.9 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.532 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.517 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 7.3 t -69.08 -25.79 64.61 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.627 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -71.39 -52.12 20.32 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.406 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.511 ' HB2' ' NE2' ' A' ' 17' ' ' HIS . 54.1 m-20 -75.72 -31.97 59.86 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.676 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 47.0 p . . . . . 0 C--N 1.321 -0.665 0 C-N-CA 120.058 -0.657 . . . . 0.0 111.894 -177.692 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.669 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.5 ttt . . . . . 0 N--CA 1.431 -1.422 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.481 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.7 mt-10 -57.1 -27.9 62.18 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.2 m -67.39 -46.77 72.3 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 120.791 0.329 . . . . 0.0 110.417 178.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -73.16 -27.73 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.726 0.774 . . . . 0.0 109.853 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.558 ' CG2' HD11 ' A' ' 26' ' ' ILE . 8.9 mm -66.77 -44.44 89.3 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.854 174.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.537 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 23.7 ttt180 -64.66 -37.32 87.16 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.367 0.417 . . . . 0.0 110.121 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 11.4 t -63.61 -43.68 96.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.75 -51.36 65.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.179 0.591 . . . . 0.0 111.65 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.537 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.4 pp -66.85 -24.52 66.15 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -176.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 C--O 1.243 0.734 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.866 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.48 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 C--O 1.218 -0.852 0 N-CA-C 115.291 0.876 . . . . 0.0 115.291 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.9 p-90 -77.49 -4.21 44.43 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 122.119 -0.636 . . . . 0.0 110.851 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -59.8 -18.09 40.94 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.267 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 11.4 pt-20 -90.32 -10.84 42.61 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.065 0.46 . . . . 0.0 111.059 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 64.6 m-70 -99.93 6.13 45.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.466 0.651 . . . . 0.0 110.575 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.42 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.1 p -127.76 110.64 22.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-N 114.913 -1.039 . . . . 0.0 108.304 177.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 m -74.94 150.16 39.16 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.121 -175.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -58.59 -38.36 77.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.305 179.336 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.511 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 16.6 m-20 -67.29 -35.62 79.85 Favored 'General case' 0 C--O 1.197 -1.706 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.56 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.411 HD13 HG21 ' A' ' 10' ' ' VAL . 3.4 tm? -67.6 -50.04 60.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -63.23 -42.01 99.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.831 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.6 t -69.47 -30.35 68.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.666 0.746 . . . . 0.0 110.235 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.615 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 12.7 t60 -75.0 -35.44 62.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.378 -178.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mp -65.63 -37.76 87.46 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 174.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.5 t -57.29 -46.02 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.565 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.0 t-80 -55.96 -47.96 76.69 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.824 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.615 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 3.4 mptp? -64.14 -37.66 88.25 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 178.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -53.53 -47.24 70.14 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.424 ' CG1' ' HE3' ' A' ' 40' ' ' MET . 24.9 t -58.84 -50.85 77.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.218 173.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.2 mt-30 -60.46 -32.67 71.62 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.46 -43.34 19.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.503 HD12 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.55 -30.48 42.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 122.078 0.942 . . . . 0.0 109.552 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -127.95 86.26 58.6 Favored Pre-proline 0 N--CA 1.402 -2.873 0 CA-C-N 114.371 -1.286 . . . . 0.0 108.547 -178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.12 78.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.11 2.54 . . . . 0.0 109.678 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 t -59.28 136.94 88.62 Favored Pre-proline 0 N--CA 1.419 -2.0 0 CA-C-N 114.387 -1.278 . . . . 0.0 113.093 -173.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -75.66 -19.35 16.59 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.774 2.316 . . . . 0.0 111.513 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -160.89 142.61 9.06 Favored Pre-proline 0 CA--C 1.51 -0.594 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -53.41 -21.18 17.36 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 C-N-CA 122.884 2.389 . . . . 0.0 114.352 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.72 60.01 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 121.295 -0.878 . . . . 0.0 112.885 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.19 56.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.023 0.916 . . . . 0.0 109.209 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 40' ' ' MET . 19.4 mt -89.69 7.11 38.38 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.999 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -132.76 19.02 4.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.745 0.783 . . . . 0.0 109.373 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.594 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.8 t70 -82.84 175.51 10.03 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.295 -178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.579 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.62 -25.91 62.35 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.901 -0.499 . . . . 0.0 111.008 177.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.6 ttp180 -69.74 -21.44 63.46 Favored 'General case' 0 C--O 1.251 1.144 0 CA-C-O 121.79 0.805 . . . . 0.0 109.597 175.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.672 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.8 tpp -63.03 -41.36 99.51 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.345 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -59.57 -31.66 69.65 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.713 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.425 HD22 HD23 ' B' ' 149' ' ' LEU . 5.5 t30 -75.38 -45.84 36.67 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.004 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.39 -42.53 92.56 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.334 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.672 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.1 p -73.4 -31.15 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -60.01 -48.4 81.85 Favored 'General case' 0 C--N 1.35 0.588 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.465 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -58.92 -46.65 87.43 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.322 175.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.23 94.52 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.07 0.231 . . . . 0.0 110.892 -178.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -62.45 -47.64 83.14 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.465 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 16.3 pttp -65.44 -35.58 81.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.109 0.48 . . . . 0.0 110.412 -177.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.73 ' O ' ' HG2' ' A' ' 54' ' ' MET . 42.8 t -70.71 -51.06 39.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.759 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -57.23 -45.51 83.83 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.352 0.661 . . . . 0.0 110.189 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.34 -38.27 96.16 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.874 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -58.13 -50.8 72.22 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.73 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.7 OUTLIER -65.98 -43.24 88.44 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.931 -175.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -56.59 -42.07 78.07 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.874 0.869 . . . . 0.0 108.774 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -83.2 -13.71 54.84 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.9 m -90.0 -24.76 21.15 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.642 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.99 164.48 11.79 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.586 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -125.22 19.08 8.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 m -158.78 153.85 25.25 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.42 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.56 -39.45 67.43 Favored 'General case' 0 C--O 1.191 -1.979 0 C-N-CA 118.954 -1.099 . . . . 0.0 111.532 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.96 -30.08 71.19 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -72.65 -49.8 29.36 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.811 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -42.48 98.56 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.434 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -57.75 -49.12 77.65 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 125.328 1.451 . . . . 0.0 109.781 174.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.524 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.3 t-80 -65.16 -50.86 64.33 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 123.223 0.327 . . . . 0.0 111.048 -173.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.6 pp -68.62 -30.99 69.83 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-O 120.991 0.424 . . . . 0.0 111.012 -176.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.7 pp -73.99 -35.54 64.45 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.454 ' HB3' HE22 ' B' ' 112' ' ' GLN . . . -64.79 -28.36 69.51 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.961 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 22.5 mm-40 -73.42 -42.58 61.88 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-O 120.994 0.426 . . . . 0.0 111.612 176.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.39 -37.45 74.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 118.626 -1.23 . . . . 0.0 110.632 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.585 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -68.77 -36.48 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.542 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 0.9 OUTLIER -51.4 -53.92 31.85 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.599 1.56 . . . . 0.0 110.801 173.508 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -67.08 -32.92 74.42 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.02 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.61 -42.98 97.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 123.045 0.215 . . . . 0.0 110.983 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.3 mt-30 -63.58 -52.25 61.78 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.567 0.699 . . . . 0.0 110.721 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 15.0 ptpt -71.05 -27.69 63.83 Favored 'General case' 0 N--CA 1.415 -2.179 0 C-N-CA 119.289 -0.964 . . . . 0.0 112.21 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.9 tp10 -59.98 -52.52 65.06 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -61.83 -42.13 98.65 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.791 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -59.26 -53.46 58.02 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.248 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -70.42 -37.04 74.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HD3' ' C ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.773 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.051 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.78 -50.11 32.82 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . 0.454 HE22 ' HB3' ' A' ' 69' ' ' ALA . 81.1 mm-40 -61.18 -44.37 97.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.609 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.22 -46.79 88.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.036 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.83 -41.7 78.31 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 20.8 mt -60.34 -62.16 2.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.433 176.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 11.1 t -63.76 -26.76 68.79 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -74.86 -56.29 4.92 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.856 0.36 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.1 -41.49 50.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 29.8 t . . . . . 0 C--N 1.325 -0.494 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 92.2 mmm . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.495 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.285 43.7 mt-10 -47.16 -27.78 1.57 Allowed 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -173.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -73.82 -49.59 24.47 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 119.156 0.889 . . . . 0.0 110.897 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -73.4 -24.4 20.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-O 122.272 1.034 . . . . 0.0 110.079 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.503 ' CG2' HD12 ' A' ' 26' ' ' ILE . 12.7 mm -70.75 -35.51 60.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.539 172.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.464 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 38.7 ttt180 -59.08 -40.98 86.93 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.8 m -57.68 -53.34 59.27 Favored 'General case' 0 CA--C 1.553 1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.641 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -66.06 -38.64 88.85 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.1 pp -73.93 -31.45 63.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' MET . . . . . 0.428 ' N ' HD12 ' B' ' 149' ' ' LEU . 39.7 tpp . . . . . 0 CA--C 1.504 -0.802 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.441 0 N-CA-C 114.366 0.507 . . . . 0.0 114.366 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -67.27 -6.07 16.81 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -61.64 -30.65 70.85 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 120.861 0.362 . . . . 0.0 111.067 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -71.85 -21.98 61.59 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.376 0.608 . . . . 0.0 111.318 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -87.43 -33.03 19.21 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.888 -176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.511 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.6 p -87.54 110.5 20.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.993 0.901 . . . . 0.0 109.788 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -71.53 149.54 45.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.908 -176.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -37.58 82.57 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -56.79 -42.64 79.84 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.287 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.32 -52.03 21.02 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.763 0.792 . . . . 0.0 109.167 -173.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.508 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.8 ptm180 -64.48 -38.5 91.24 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.239 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 t -73.9 -23.98 59.64 Favored 'General case' 0 N--CA 1.424 -1.765 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -70.94 -37.5 72.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -40.22 94.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.394 174.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 15' ' ' ARG . 83.9 t -58.84 -45.97 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.364 0.666 . . . . 0.0 109.652 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -55.47 -47.29 76.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.173 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HD3' HD22 ' B' ' 115' ' ' LEU . 35.7 mttp -66.21 -36.87 84.17 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.312 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.4 mt -56.41 -45.39 80.71 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 123.241 0.338 . . . . 0.0 110.188 174.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -48.87 83.98 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 O-C-N 123.772 0.67 . . . . 0.0 111.813 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -71.76 -23.58 61.62 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.502 -176.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.34 21.98 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.406 176.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.528 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.52 -34.36 57.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.61 87.09 56.88 Favored Pre-proline 0 N--CA 1.41 -2.467 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.623 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -68.06 77.3 0.62 Allowed 'Trans proline' 0 C--O 1.262 1.685 0 C-N-CA 122.5 2.133 . . . . 0.0 108.61 168.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.4 t -54.88 143.95 49.29 Favored Pre-proline 0 N--CA 1.427 -1.621 0 CA-C-N 113.444 -1.707 . . . . 0.0 113.142 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.32 -36.31 28.18 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.264 1.976 . . . . 0.0 110.66 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -149.03 142.13 15.77 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -53.81 -21.12 19.27 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.256 2.637 . . . . 0.0 115.307 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.83 -11.06 59.66 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 121.035 -1.041 . . . . 0.0 112.468 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.44 -12.86 60.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.181 0.991 . . . . 0.0 108.758 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -84.2 7.23 19.72 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.463 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -132.98 20.41 4.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.766 0.793 . . . . 0.0 109.791 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.572 ' O ' ' HB3' ' A' ' 40' ' ' MET . 35.4 t70 -86.86 174.97 8.42 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.82 -25.22 67.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.944 0.402 . . . . 0.0 110.375 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.491 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.9 ttm180 -65.56 -31.37 72.38 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.572 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 10.2 tpp -60.73 -39.27 88.01 Favored 'General case' 0 CA--C 1.496 -1.128 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.099 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -33.67 76.51 Favored 'General case' 0 C--O 1.199 -1.555 0 C-N-CA 117.381 -1.727 . . . . 0.0 110.048 -177.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -66.59 -46.29 76.43 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 124.039 0.837 . . . . 0.0 110.386 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 85.8 mt -65.72 -47.05 76.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.928 -177.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.475 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.6 p -73.27 -31.87 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.1 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.09 94.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.497 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -60.12 -47.41 86.01 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 124.208 1.003 . . . . 0.0 110.322 174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.15 -45.24 94.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.773 -0.194 . . . . 0.0 110.738 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -62.85 -40.04 96.24 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.881 0.472 . . . . 0.0 111.474 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 48.4 pttt -73.55 -36.37 65.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.862 0.363 . . . . 0.0 110.979 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.4 -45.92 84.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -54.98 -47.85 74.03 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.831 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.77 97.1 Favored Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.793 -0.64 . . . . 0.0 113.206 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.63 -54.32 48.41 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.762 0.315 . . . . 0.0 110.962 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.529 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 1.8 ptp -70.17 -30.88 68.13 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -60.99 -49.59 76.81 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.453 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 6.1 mm-40 -73.3 -24.31 60.39 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.46 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 37.9 m -76.16 -34.46 59.37 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.852 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.5 164.72 14.69 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.138 0.494 . . . . 0.0 111.967 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.04 15.37 13.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.001 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.5 m -158.4 150.48 21.65 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.511 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.38 -34.34 67.87 Favored 'General case' 0 C--O 1.187 -2.19 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.319 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -69.39 -32.24 71.12 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.874 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 11.9 tp10 -66.56 -51.68 53.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -39.25 92.23 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.784 -177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.65 ' CE1' HD12 ' B' ' 115' ' ' LEU . 11.9 t80 -61.46 -47.13 87.09 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.145 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.57 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 55.8 m80 -70.68 -43.54 68.84 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.529 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.6 pp -68.53 -31.09 70.07 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 120.379 -0.528 . . . . 0.0 112.186 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.493 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.7 OUTLIER -74.48 -39.27 62.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.447 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -54.22 -40.82 68.0 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.681 173.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 45.7 mm-40 -60.16 -48.56 81.23 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.511 0.672 . . . . 0.0 110.577 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 1.6 tptt -62.09 -48.31 80.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.322 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.573 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -34.34 67.35 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.186 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.453 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 5.4 t80 -55.5 -53.52 55.34 Favored 'General case' 0 C--O 1.257 1.477 0 C-N-CA 125.348 1.459 . . . . 0.0 110.943 174.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.7 ptpt -64.35 -34.36 77.97 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.717 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.75 -43.95 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 123.326 0.391 . . . . 0.0 110.49 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.8 mt-30 -64.59 -52.12 59.17 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.9 -176.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.0 ptpt -71.16 -29.05 64.72 Favored 'General case' 0 N--CA 1.419 -1.997 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.1 -177.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 82' ' ' LYS . 48.9 tp10 -63.22 -51.77 64.9 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.506 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -64.0 -39.72 94.76 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -68.52 -44.37 74.76 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.7 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -69.17 -45.15 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 119.869 -0.732 . . . . 0.0 112.199 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.73 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.36 -53.12 48.17 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.481 -176.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . 0.366 0.0 OUTLIER -75.3 -27.61 59.4 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -176.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -73.68 -42.21 61.6 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.483 175.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.54 -45.78 90.79 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.65 HD12 ' CE1' ' A' ' 65' ' ' TYR . 9.0 mt -50.01 -61.77 1.96 Allowed 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.494 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -62.32 -42.29 99.25 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.623 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 41.9 m -63.94 -37.39 87.25 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.307 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -77.06 -53.1 8.21 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.323 -0.567 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -171.103 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.592 ' O ' HG12 ' B' ' 145' ' ' ILE . 7.7 tpt . . . . . 0 N--CA 1.444 -0.77 0 CA-C-O 121.708 0.765 . . . . 0.0 109.117 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 50.4 mt-10 -52.57 -27.22 15.86 Favored 'General case' 0 C--O 1.199 -1.586 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.9 p -58.06 -59.96 4.47 Favored 'General case' 0 C--O 1.265 1.87 0 CA-C-O 122.083 0.944 . . . . 0.0 110.926 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.51 HD13 ' SD ' ' B' ' 141' ' ' MET . 41.8 pt -64.61 -29.93 48.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.61 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.592 HG12 ' O ' ' B' ' 141' ' ' MET . 17.7 mm -67.25 -40.56 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.007 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 99.1 mtt180 -59.58 -42.01 91.56 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.2 m -58.07 -47.36 83.41 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.903 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.82 -38.4 73.28 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.492 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -71.09 -31.19 67.5 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.752 -0.592 . . . . 0.0 110.369 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.277 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.111 0 N-CA-C 114.93 0.732 . . . . 0.0 114.93 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.4 p-90 -72.32 -9.62 58.73 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.71 -15.72 54.09 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 10.9 pt-20 -89.09 -9.3 51.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.288 0.566 . . . . 0.0 110.086 177.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.0 m-70 -96.24 4.23 52.52 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.272 0.558 . . . . 0.0 109.77 -178.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.503 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 1.1 t -118.46 113.0 40.52 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.412 0 N-CA-C 104.716 -2.328 . . . . 0.0 104.716 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.0 m -65.98 149.93 49.46 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -57.35 -39.98 77.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.334 0.588 . . . . 0.0 109.503 177.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.1 m-20 -63.96 -35.01 79.29 Favored 'General case' 0 C--O 1.196 -1.719 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.04 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.39 -51.44 15.02 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.457 ' O ' HG22 ' A' ' 19' ' ' VAL . 11.9 ptm180 -59.41 -42.74 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.106 0.479 . . . . 0.0 111.278 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.413 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 21.2 t -73.0 -24.84 60.8 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.36 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.583 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 10.3 t60 -74.94 -34.8 62.13 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.339 0.59 . . . . 0.0 109.749 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.0 mp -63.82 -39.14 93.53 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 173.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.457 HG22 ' O ' ' A' ' 15' ' ' ARG . 95.8 t -59.05 -49.68 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-O 121.667 0.746 . . . . 0.0 109.464 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.459 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 28.5 t-80 -51.29 -49.46 61.24 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.925 1.29 . . . . 0.0 111.098 177.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.583 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 55.2 mttm -64.77 -36.87 85.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.395 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.1 -47.51 77.92 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.389 0.431 . . . . 0.0 110.222 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.88 -49.15 84.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 O-C-N 123.769 0.668 . . . . 0.0 112.007 176.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -70.0 -23.21 63.11 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.449 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -81.2 -44.23 18.13 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.472 176.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.554 HD13 ' CG2' ' B' ' 145' ' ' ILE . 4.9 tt -70.73 -32.99 51.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.477 0.656 . . . . 0.0 110.149 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -127.62 93.57 39.98 Favored Pre-proline 0 N--CA 1.416 -2.155 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.1 -177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -66.86 96.42 0.37 Allowed 'Trans proline' 0 N--CA 1.446 -1.32 0 C-N-CA 121.794 1.663 . . . . 0.0 108.141 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.477 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 11.0 t -74.35 139.17 75.01 Favored Pre-proline 0 N--CA 1.419 -1.978 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.992 -171.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 -28.62 5.83 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.241 2.627 . . . . 0.0 111.717 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -140.23 146.23 44.99 Favored Pre-proline 0 CA--C 1.483 -1.629 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 -177.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -67.26 -12.58 36.43 Favored 'Trans proline' 0 C--N 1.323 -0.774 0 C-N-CA 121.411 1.408 . . . . 0.0 110.787 174.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.15 57.65 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.745 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.477 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -77.84 -11.8 59.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.101 0.953 . . . . 0.0 108.654 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.548 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.8 mt -87.79 3.82 46.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.828 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -133.04 21.52 4.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.697 0.761 . . . . 0.0 109.532 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 40' ' ' MET . 17.4 t70 -89.08 172.24 9.25 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.716 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.23 -25.76 65.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.419 0.628 . . . . 0.0 110.928 -178.788 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 -76.74 -16.21 59.55 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.613 0.72 . . . . 0.0 109.56 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.552 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.5 tpp -65.5 -40.31 92.9 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.182 176.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.5 pt-20 -62.09 -27.88 69.22 Favored 'General case' 0 C--O 1.192 -1.921 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.055 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.48 -47.41 55.67 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.196 0.598 . . . . 0.0 110.565 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.25 -45.96 75.15 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.426 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.494 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -72.6 -30.74 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.141 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.43 94.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.438 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.6 t80 -56.92 -46.59 81.89 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.675 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.78 -47.8 81.91 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.441 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -62.59 -40.11 95.85 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.14 0.576 . . . . 0.0 112.362 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.438 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.8 pttp -72.51 -38.32 68.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.809 0.338 . . . . 0.0 110.681 -177.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.6 t -69.28 -47.08 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -58.71 -47.6 84.02 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.663 0.785 . . . . 0.0 109.34 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.51 -39.73 93.49 Favored Glycine 0 C--O 1.224 -0.507 0 O-C-N 123.644 0.59 . . . . 0.0 112.667 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -59.84 -54.75 42.56 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.946 0.403 . . . . 0.0 111.19 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.457 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -66.74 -32.54 73.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.382 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.29 -49.78 76.25 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 123.902 0.881 . . . . 0.0 109.706 173.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.43 -21.08 60.56 Favored 'General case' 0 C--N 1.31 -1.152 0 O-C-N 122.033 -0.417 . . . . 0.0 111.986 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -84.55 -39.46 18.76 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.63 169.76 15.91 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -174.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.35 6.49 16.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.685 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -164.34 151.57 11.71 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.503 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -63.46 -35.77 81.54 Favored 'General case' 0 C--O 1.178 -2.676 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.141 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.17 -36.15 82.66 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 123.923 0.764 . . . . 0.0 110.379 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -71.81 -46.66 57.43 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.826 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -40.42 95.81 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.523 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.503 ' HH ' ' HB ' ' B' ' 116' ' ' THR . 0.3 OUTLIER -56.15 -49.91 72.65 Favored 'General case' 0 C--O 1.209 -1.045 0 C-N-CA 125.13 1.372 . . . . 0.0 109.369 174.499 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 35.9 t-80 -64.58 -54.16 36.39 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.419 -172.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.414 HD12 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.82 -29.97 69.26 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.447 -177.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.457 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -74.02 -38.26 64.11 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.725 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.7 -32.34 73.41 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 123.398 0.437 . . . . 0.0 109.838 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 12.1 mm-40 -70.85 -41.56 71.29 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 176.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -37.59 66.65 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 118.954 -1.098 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.581 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.7 tt -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.529 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.85 -54.12 38.92 Favored 'General case' 0 C--O 1.252 1.205 0 C-N-CA 125.004 1.321 . . . . 0.0 111.269 174.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -67.91 -34.81 77.35 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.911 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.97 -42.81 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 123.558 0.536 . . . . 0.0 110.476 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.4 mt-30 -61.82 -57.02 13.43 Favored 'General case' 0 CA--C 1.484 -1.567 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.081 -178.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -66.23 -32.5 73.96 Favored 'General case' 0 N--CA 1.418 -2.057 0 C-N-CA 119.78 -0.768 . . . . 0.0 112.839 -176.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -59.45 -52.68 64.56 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.462 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -68.2 -41.7 80.96 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.964 -177.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.7 -43.34 99.05 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.6 pt-20 -75.5 -36.66 60.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.657 -177.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.512 ' HZ2' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.519 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' THR . . . . . 0.453 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.442 -0.856 0 CA-C-O 120.269 0.081 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.42 -48.29 56.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -60.66 -43.76 97.26 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.291 0.369 . . . . 0.0 111.107 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.71 -38.58 80.35 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.176 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' B' ' 110' ' ' THR . 81.7 mt -63.16 -38.89 92.97 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.294 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -56.7 -66.58 0.42 Allowed 'General case' 0 C--O 1.214 -0.808 0 O-C-N 123.362 0.414 . . . . 0.0 110.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.503 ' HB ' ' HH ' ' A' ' 65' ' ' TYR . 9.0 t -56.96 -46.94 81.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -173.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.1 t -72.21 -46.82 54.6 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.994 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -76.58 -36.34 57.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.53 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 72.6 p . . . . . 0 CA--C 1.504 -0.797 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.618 ' SD ' HD12 ' B' ' 144' ' ' ILE . 13.9 tpt . . . . . 0 C--O 1.24 0.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.537 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.4 mt-10 -49.66 -26.46 3.71 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.3 p -60.31 -59.47 5.36 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 121.362 0.601 . . . . 0.0 111.534 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.618 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.6 pp -70.78 -24.94 25.4 Favored 'Isoleucine or valine' 0 C--O 1.264 1.826 0 CA-C-O 122.28 1.038 . . . . 0.0 111.469 177.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.554 ' CG2' HD13 ' A' ' 26' ' ' ILE . 15.2 mm -65.1 -39.29 85.1 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.201 172.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -65.52 -40.7 93.27 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.885 177.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 5.2 p -60.75 -28.87 69.03 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.919 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -79.56 -52.23 8.27 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 119.13 -1.028 . . . . 0.0 112.198 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 2.4 pp -72.88 -23.12 60.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 17.0 tpt . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 109.928 -178.93 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 N-CA-C 115.578 0.991 . . . . 0.0 115.578 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.436 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 67.5 p-90 -67.46 -9.2 39.68 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.442 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -67.09 -17.73 65.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.188 0.518 . . . . 0.0 110.765 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.87 -10.0 59.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 121.243 0.544 . . . . 0.0 109.794 176.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.436 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 15.6 m-70 -96.72 4.55 51.76 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.48 -178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.408 HG22 HD12 ' A' ' 14' ' ' LEU . 7.5 p -138.09 110.66 6.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-O 122.068 0.937 . . . . 0.0 109.363 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -86.63 162.92 17.7 Favored 'General case' 0 N--CA 1.414 -2.245 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.788 -177.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.85 -36.85 77.71 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.754 -178.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -57.25 -45.5 83.93 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.411 HD22 ' HB3' ' B' ' 119' ' ' SER . 3.3 tm? -69.61 -50.98 39.24 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.718 0.771 . . . . 0.0 108.945 -175.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.537 ' O ' HG21 ' A' ' 19' ' ' VAL . 4.5 ptm180 -66.41 -41.35 89.4 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.064 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 t -70.79 -25.36 62.85 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.431 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 46.9 t60 -67.66 -40.55 84.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.433 HD13 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -65.32 -36.12 83.06 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.078 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.537 HG21 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -59.55 -44.73 93.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 123.521 0.728 . . . . 0.0 109.358 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.431 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.8 t-80 -58.77 -42.34 88.71 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.127 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.529 ' NZ ' ' HB2' ' B' ' 118' ' ' ASP . 72.7 mttt -71.27 -36.32 71.68 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.1 mt -57.02 -44.09 82.49 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.9 t -58.01 -50.41 78.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 O-C-N 124.117 0.886 . . . . 0.0 111.827 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.65 -17.67 62.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.62 -46.33 13.42 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.452 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.56 HD12 ' CG2' ' B' ' 145' ' ' ILE . 4.4 tt -70.69 -36.79 66.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 122.05 0.929 . . . . 0.0 108.925 -177.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.452 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 5.5 m-85 -130.16 88.06 49.27 Favored Pre-proline 0 N--CA 1.397 -3.087 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.624 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -61.6 94.44 0.12 Allowed 'Trans proline' 0 N--CA 1.438 -1.74 0 C-N-CA 121.878 1.719 . . . . 0.0 108.489 173.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -68.72 136.75 90.26 Favored Pre-proline 0 N--CA 1.401 -2.923 0 CA-C-N 113.883 -1.508 . . . . 0.0 111.68 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.18 -32.52 4.06 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.511 2.141 . . . . 0.0 110.612 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -137.46 146.27 52.88 Favored Pre-proline 0 CA--C 1.482 -1.659 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.122 -174.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -68.5 -11.45 31.98 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.626 1.551 . . . . 0.0 111.446 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.88 -9.23 54.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.57 -13.41 59.92 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.57 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.3 mt -84.53 7.24 20.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 113.921 -1.49 . . . . 0.0 110.612 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -131.87 14.04 4.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.756 0.789 . . . . 0.0 109.613 176.038 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.6 t70 -81.16 171.04 15.38 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.526 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -64.18 -28.57 69.84 Favored 'General case' 0 C--N 1.31 -1.129 0 O-C-N 122.14 -0.35 . . . . 0.0 111.289 -179.157 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.452 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 19.7 ttm180 -70.3 -20.16 63.04 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 35' ' ' LEU . 7.7 tpp -63.84 -42.87 97.5 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.444 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.48 -33.87 73.22 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.86 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -68.69 -48.21 64.48 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.48 -42.08 83.53 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.032 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.563 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.0 p -73.09 -33.55 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -62.07 -48.82 78.49 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 175.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.549 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 1.7 t80 -56.28 -42.89 78.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.099 0.96 . . . . 0.0 110.512 174.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.14 -38.46 78.83 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.986 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.3 mttm -64.36 -39.57 94.14 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 120.67 0.271 . . . . 0.0 111.364 177.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 4.3 ptmt -68.0 -44.14 77.25 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.477 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.2 t -62.32 -50.44 79.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -56.31 -50.06 72.53 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.371 1.068 . . . . 0.0 109.26 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.78 -32.78 80.35 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.137 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -70.07 -49.34 52.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.932 0.396 . . . . 0.0 110.732 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.411 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.5 OUTLIER -65.8 -30.33 70.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 177.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.442 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 78.1 t80 -61.75 -42.35 98.85 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 3.4 mm-40 -82.03 -13.27 57.61 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 t -87.63 -27.14 22.67 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-O 121.105 0.479 . . . . 0.0 110.56 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -95.55 165.83 12.15 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -116.54 8.52 13.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.709 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.0 p -158.42 156.66 30.81 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -32.94 67.35 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.853 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.78 -37.63 88.27 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 178.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -64.96 -47.47 77.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.903 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -40.99 98.32 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.048 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.689 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 7.0 t80 -64.01 -42.98 96.98 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.161 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.48 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.4 m80 -62.77 -57.21 11.73 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.05 176.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.23 -30.22 71.29 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 1.0 OUTLIER -72.36 -46.51 55.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 175.606 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' A' ' 73' ' ' TYR . . . -53.86 -34.27 58.88 Favored 'General case' 0 C--O 1.207 -1.16 0 O-C-N 123.825 0.703 . . . . 0.0 110.809 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.696 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 14.1 mt-10 -74.09 -45.35 49.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -67.72 -37.69 82.58 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.944 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.544 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 2.4 tt -69.31 -35.67 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.696 ' CD2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -69.45 -38.54 77.82 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.286 -178.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -68.19 -33.29 74.16 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.386 0.428 . . . . 0.0 110.068 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.66 -41.45 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.066 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 49.7 mt-30 -65.37 -45.43 84.12 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 120.957 0.408 . . . . 0.0 110.617 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.5 ptpt -71.41 -26.98 62.99 Favored 'General case' 0 N--CA 1.424 -1.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.72 -47.02 73.66 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -66.38 -34.42 77.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.084 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -65.66 -53.32 42.96 Favored 'General case' 0 N--CA 1.407 -2.579 0 C-N-CA 124.007 0.923 . . . . 0.0 110.314 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -62.29 -38.18 88.38 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.482 ' HE2' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.026 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.426 -1.672 0 CA-C-O 121.043 0.449 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.93 -51.98 16.4 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.535 -173.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -67.52 -36.73 81.6 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.517 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.69 -46.36 82.71 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.006 0.432 . . . . 0.0 110.112 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.83 -44.78 96.48 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.261 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.689 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 21.9 mt -55.09 -67.29 0.28 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.856 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 13.7 t -58.0 -28.91 64.85 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.8 p -73.97 -52.6 12.31 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.809 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.529 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 53.6 m-20 -76.21 -43.74 40.88 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 119.154 -1.018 . . . . 0.0 112.319 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.411 ' HB3' HD22 ' A' ' 14' ' ' LEU . 20.1 m . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 121.547 0.689 . . . . 0.0 111.705 -173.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.482 ' SD ' ' HE2' ' A' ' 82' ' ' LYS . 11.9 tpt . . . . . 0 C--O 1.239 0.501 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.528 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -50.89 -27.13 6.83 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.0 m -58.78 -53.53 57.38 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-O 121.053 0.454 . . . . 0.0 110.681 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.404 HD11 ' HE3' ' B' ' 141' ' ' MET 0.25 2.7 pp -73.92 -24.17 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 121.164 0.506 . . . . 0.0 111.147 178.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.56 ' CG2' HD12 ' A' ' 26' ' ' ILE . 13.8 mm -65.17 -42.52 94.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.081 172.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.479 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 49.0 ttp180 -62.08 -37.67 85.91 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.674 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.2 m -56.55 -53.89 52.28 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 123.662 0.601 . . . . 0.0 110.224 172.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.2 -41.54 90.05 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' B' ' 146' ' ' ARG 0.268 3.4 pp -68.29 -31.23 70.53 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.57 -0.707 . . . . 0.0 111.764 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 C--N 1.318 -0.776 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.454 177.092 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.912 0 N-CA-C 116.424 1.33 . . . . 0.0 116.424 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -79.9 -3.0 46.18 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 121.543 -0.975 . . . . 0.0 110.027 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -60.84 -32.34 71.74 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 125.936 1.695 . . . . 0.0 108.809 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -81.71 -4.26 55.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.147 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -109.23 -15.67 14.24 Favored 'General case' 0 CA--C 1.499 -1.002 0 CA-C-O 121.3 0.571 . . . . 0.0 111.627 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.422 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 7.5 p -101.98 109.8 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.179 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -81.22 150.5 28.58 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.256 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.21 -39.96 73.29 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 123.542 0.526 . . . . 0.0 110.146 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -64.07 -33.58 76.08 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.859 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -73.72 -48.08 34.64 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -174.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.466 ' O ' HG23 ' A' ' 19' ' ' VAL . 8.3 ptm180 -69.8 -41.49 74.97 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.276 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.7 t -70.18 -23.09 62.91 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.469 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 18.8 t60 -71.07 -42.37 69.5 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.459 HD23 HD21 ' A' ' 68' ' ' LEU . 1.9 mp -62.06 -38.25 88.07 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.463 176.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 15' ' ' ARG . 93.8 t -60.31 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.19 0.596 . . . . 0.0 109.505 172.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -52.96 -46.61 68.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.699 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.469 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 61.5 mttm -65.66 -39.47 91.4 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.7 mt -55.31 -45.5 76.32 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.358 0.411 . . . . 0.0 110.142 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.418 ' CG1' ' HE2' ' A' ' 40' ' ' MET . 30.9 t -60.49 -55.01 27.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 O-C-N 123.852 0.72 . . . . 0.0 111.187 175.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.04 -26.74 68.42 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -176.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.492 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.52 -45.84 15.35 Favored 'General case' 0 C--O 1.206 -1.228 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.576 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.505 HD13 ' CG2' ' B' ' 145' ' ' ILE . 4.2 tt -70.43 -28.35 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 121.952 0.882 . . . . 0.0 109.639 -177.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.1 86.5 51.22 Favored Pre-proline 0 N--CA 1.394 -3.25 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.445 -177.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.76 98.49 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.399 0 C-N-CA 122.244 1.963 . . . . 0.0 107.413 168.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 t -73.61 142.86 81.32 Favored Pre-proline 0 N--CA 1.408 -2.546 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.653 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.53 -24.74 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.385 2.056 . . . . 0.0 111.435 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -155.7 142.61 13.55 Favored Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -174.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.31 -24.68 61.25 Favored 'Trans proline' 0 C--N 1.321 -0.873 0 C-N-CA 122.73 2.287 . . . . 0.0 114.659 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.33 -8.11 58.83 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.248 -0.908 . . . . 0.0 111.936 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.2 -11.39 59.82 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.733 0.777 . . . . 0.0 109.185 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.7 mt -87.73 3.49 47.83 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.262 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.0 19.22 4.1 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 122.534 1.159 . . . . 0.0 109.169 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.673 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.0 t70 -83.34 177.77 8.35 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.092 -177.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.673 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.29 -33.26 71.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.123 0.487 . . . . 0.0 110.158 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -69.21 -20.33 63.98 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 122.112 0.958 . . . . 0.0 109.935 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.595 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -62.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.696 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.449 ' O ' ' HB1' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -62.39 -32.77 73.64 Favored 'General case' 0 C--O 1.174 -2.895 0 C-N-CA 118.144 -1.422 . . . . 0.0 110.785 -178.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.21 -47.98 66.43 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.591 0.557 . . . . 0.0 110.872 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.6 -44.64 77.62 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.863 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.595 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.7 p -73.46 -32.72 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.027 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -61.16 -45.45 94.58 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.629 0.728 . . . . 0.0 109.094 176.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.466 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -58.56 -47.09 85.38 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.496 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.01 98.17 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.801 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 94.1 mttt -63.24 -44.0 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.106 0.563 . . . . 0.0 111.315 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.5 pttp -68.46 -39.42 81.43 Favored 'General case' 0 C--O 1.25 1.095 0 CA-C-O 121.307 0.575 . . . . 0.0 110.605 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.42 -50.83 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.687 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -56.71 -48.51 77.55 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.142 0.977 . . . . 0.0 109.668 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.97 -40.24 93.01 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.38 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -61.52 -55.25 33.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-O 120.336 0.112 . . . . 0.0 110.879 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.428 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -64.75 -28.61 69.7 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.735 0.642 . . . . 0.0 112.735 179.743 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -64.53 -51.68 61.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -70.64 -24.42 62.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.62 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 64.9 m -82.29 -33.61 29.0 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.5 164.75 18.61 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.326 0.584 . . . . 0.0 112.422 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -113.15 13.6 19.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.402 0.62 . . . . 0.0 111.351 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.6 p -163.78 153.9 15.16 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 171.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.422 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -70.36 -33.67 71.72 Favored 'General case' 0 C--O 1.188 -2.177 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.312 -178.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.97 -35.82 82.41 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -67.07 -46.91 72.87 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.286 175.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.63 -44.82 95.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.773 0.671 . . . . 0.0 109.609 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -49.33 75.61 Favored 'General case' 0 C--O 1.208 -1.125 0 C-N-CA 125.077 1.351 . . . . 0.0 109.492 175.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -63.5 -49.61 72.87 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.62 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 pp -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.628 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.459 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.06 -36.89 58.82 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 177.444 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -63.44 -36.56 84.14 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.02 -47.29 83.71 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.633 0.73 . . . . 0.0 110.954 174.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.41 ' HZ3' HG12 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -63.65 -44.38 93.98 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.5 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.48 HG23 ' HA ' ' A' ' 69' ' ' ALA . 4.9 tt -69.58 -35.77 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.374 -177.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.537 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.46 -54.25 43.44 Favored 'General case' 0 C--O 1.26 1.625 0 C-N-CA 124.525 1.13 . . . . 0.0 110.936 175.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.15 -32.4 73.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.374 -176.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.41 HG12 ' HZ3' ' A' ' 71' ' ' LYS . 1.4 mp -65.24 -45.71 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.821 177.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.492 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 36.4 mt-30 -59.28 -53.83 53.75 Favored 'General case' 0 CA--C 1.481 -1.705 0 O-C-N 123.798 0.686 . . . . 0.0 111.364 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.648 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -67.7 -35.22 78.41 Favored 'General case' 0 N--CA 1.415 -2.21 0 C-N-CA 119.192 -1.003 . . . . 0.0 112.524 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 12.0 tp10 -59.98 -48.86 79.96 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.449 HD23 ' O ' ' A' ' 25' ' ' ALA . 4.6 pp -67.11 -43.77 81.64 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.6 -49.85 69.49 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 123.28 0.362 . . . . 0.0 111.356 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -68.36 -31.74 71.33 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? . . . . . 0 N--CA 1.453 -0.294 0 C-N-CA 120.107 -0.637 . . . . 0.0 111.45 178.715 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' THR . . . . . 0.608 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 5.3 t . . . . . 0 N--CA 1.434 -1.26 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.54 -42.82 67.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.973 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.57 -35.31 79.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -66.52 -44.47 82.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.056 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' B' ' 110' ' ' THR . 71.8 mt -60.5 -42.73 96.94 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.041 0.448 . . . . 0.0 109.795 177.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.63 -59.02 5.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.686 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 19.4 m -60.93 -44.14 97.64 Favored 'General case' 0 C--O 1.247 0.929 0 O-C-N 123.858 0.724 . . . . 0.0 111.347 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 44.7 m -62.9 -46.66 86.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.537 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.415 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 17.2 m-20 -76.22 -41.36 49.55 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 118.556 -1.258 . . . . 0.0 111.835 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 53.7 p . . . . . 0 C--N 1.326 -0.431 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -173.423 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.525 ' SD ' HD12 ' B' ' 144' ' ' ILE . 10.8 tpt . . . . . 0 C--O 1.246 0.906 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.555 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.2 mt-10 -47.53 -26.17 1.34 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.2 m -55.94 -59.26 5.15 Favored 'General case' 0 C--O 1.259 1.599 0 CA-C-O 121.701 0.762 . . . . 0.0 111.138 174.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.525 HD12 ' SD ' ' B' ' 141' ' ' MET 0.291 2.6 pp -72.52 -23.59 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 O-C-N 121.356 -0.84 . . . . 0.0 111.674 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.555 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 29.2 mm -67.39 -38.55 80.99 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.801 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.675 172.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.436 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 15.2 tpp180 -59.14 -43.96 92.04 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.2 m -58.37 -48.16 81.51 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.598 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -72.07 -37.35 69.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.436 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.9 pp -68.34 -24.58 64.83 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.332 -0.855 . . . . 0.0 110.27 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.3 tpt . . . . . 0 N--CA 1.437 -1.081 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 173.11 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.376 0 N-CA-C 114.404 0.521 . . . . 0.0 114.404 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.542 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 65.4 p-90 -63.91 -19.89 65.44 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -61.94 -20.72 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.277 0.56 . . . . 0.0 111.393 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -82.5 -10.78 58.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -108.58 8.31 27.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.867 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.3 p -129.66 118.54 45.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 CA-C-O 121.317 0.579 . . . . 0.0 110.043 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -85.8 153.1 22.51 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.287 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -38.29 70.09 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-O 121.016 0.436 . . . . 0.0 110.765 177.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.73 -27.72 65.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.38 -51.15 18.39 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' O ' HG22 ' A' ' 19' ' ' VAL . 6.1 ptm180 -64.78 -38.28 90.45 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.837 -179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -70.01 -26.41 64.05 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -73.53 -36.17 65.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.441 HD21 HD23 ' A' ' 68' ' ' LEU . 2.4 mp -63.43 -39.13 93.65 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.467 HG22 ' O ' ' A' ' 15' ' ' ARG . 70.2 t -59.19 -49.93 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.405 0.682 . . . . 0.0 109.31 172.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -52.31 -46.33 65.95 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 124.569 1.148 . . . . 0.0 110.814 176.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.402 ' CE ' ' HB2' ' B' ' 118' ' ' ASP . 55.0 mttm -64.15 -42.36 96.81 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.277 177.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.4 mt -54.63 -46.06 73.83 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -57.38 -49.97 78.43 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.758 175.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -68.03 -24.15 65.07 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.425 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -80.37 -46.34 16.21 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.003 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.537 HD12 ' CG2' ' B' ' 145' ' ' ILE . 3.9 tt -70.89 -29.33 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.958 0.885 . . . . 0.0 110.003 -178.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -127.14 90.74 48.41 Favored Pre-proline 0 N--CA 1.401 -2.901 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.025 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -55.64 127.31 25.63 Favored 'Trans proline' 0 N--CA 1.447 -1.244 0 C-N-CA 122.398 2.065 . . . . 0.0 108.22 170.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 p -70.46 120.59 79.61 Favored Pre-proline 0 C--N 1.283 -2.308 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -87.17 -26.5 0.82 Allowed 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.067 1.178 . . . . 0.0 109.046 167.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -154.13 140.61 12.9 Favored Pre-proline 0 CA--C 1.495 -1.149 0 C-N-CA 125.471 1.508 . . . . 0.0 107.225 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -67.42 -19.48 49.24 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.276 1.318 . . . . 0.0 110.586 171.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.61 -6.81 59.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -13.99 59.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 122.333 1.063 . . . . 0.0 108.43 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.0 4.49 16.82 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.102 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.41 22.92 3.73 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.16 0.505 . . . . 0.0 110.987 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.432 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 10.2 t70 -87.56 -176.99 5.78 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -71.3 -17.44 62.46 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 119.823 1.192 . . . . 0.0 110.418 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 21.9 ttm180 -70.97 -20.31 62.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.404 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.668 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.8 tpp -66.94 -42.89 84.52 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.07 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.8 pt-20 -59.86 -29.53 68.36 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.062 -0.655 . . . . 0.0 109.869 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.3 t30 -73.61 -51.53 16.52 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 124.571 1.148 . . . . 0.0 110.346 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.22 -44.17 80.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.749 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.668 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -72.62 -33.33 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.893 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.071 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -58.57 -45.26 89.38 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.0 t80 -60.41 -50.49 73.37 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.696 174.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.88 -39.66 90.07 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 120.714 0.292 . . . . 0.0 110.951 -176.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.2 mttt -65.22 -45.24 85.5 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 123.373 0.669 . . . . 0.0 111.552 177.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.9 pttp -65.72 -39.25 90.98 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.152 0.501 . . . . 0.0 109.726 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' A' ' 54' ' ' MET . 53.5 t -67.09 -52.39 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.807 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -55.59 -50.11 70.97 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 124.122 0.889 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.06 -40.7 97.42 Favored Glycine 0 CA--C 1.507 -0.461 0 O-C-N 123.607 0.567 . . . . 0.0 112.642 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.39 -54.26 48.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.031 0.443 . . . . 0.0 110.187 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.499 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.6 ptp -70.26 -30.51 67.56 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.28 -40.97 97.05 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.74 -24.97 44.53 Favored 'General case' 0 C--N 1.313 -1.003 0 O-C-N 121.149 -0.969 . . . . 0.0 112.067 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.469 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 50.0 m -86.67 -18.8 30.37 Favored 'General case' 0 C--N 1.277 -2.561 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -175.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.25 160.14 14.82 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -98.59 -2.66 38.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.689 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.542 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 81.2 p -158.64 161.67 37.2 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -29.74 66.36 Favored 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.915 177.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.77 -41.57 83.08 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.544 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 7.6 tp10 -62.97 -49.53 74.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 176.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -43.64 98.25 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.782 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.502 ' HH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -54.21 -48.88 70.55 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 172.625 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.0 -55.8 16.87 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.787 -172.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 2.1 pp -65.62 -30.16 70.84 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.499 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -75.92 -39.26 56.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 177.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -61.66 -32.94 73.14 Favored 'General case' 0 C--N 1.351 0.639 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.9 mm-40 -65.56 -47.08 77.05 Favored 'General case' 0 C--O 1.249 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 111.705 174.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.09 -36.3 66.78 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.039 -1.064 . . . . 0.0 112.048 -177.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.608 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.8 tt -65.35 -37.8 80.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.785 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.49 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 12.5 t80 -54.25 -54.02 45.77 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 124.599 1.16 . . . . 0.0 111.907 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.521 ' HB3' ' HZ2' ' A' ' 74' ' ' LYS . 0.6 OUTLIER -65.41 -32.94 74.83 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.848 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.6 -41.02 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.608 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 51.5 mt-30 -64.27 -48.26 76.4 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.537 0.684 . . . . 0.0 110.622 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.84 -26.55 59.78 Favored 'General case' 0 N--CA 1.398 -3.057 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.6 tt0 -61.51 -48.63 80.17 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.727 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -66.51 -38.2 86.69 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.926 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -64.11 -47.85 78.4 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -63.48 -41.06 98.58 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 118.268 0.485 . . . . 0.0 111.543 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.443 -0.777 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.434 -178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' THR . . . . . 0.641 ' HA ' ' OD2' ' B' ' 113' ' ' ASP . 7.6 t . . . . . 0 C--O 1.218 -0.599 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.79 -35.53 81.38 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.256 175.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -64.55 -40.16 95.07 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . 0.641 ' OD2' ' HA ' ' B' ' 110' ' ' THR . 38.2 m-20 -54.17 -48.51 70.85 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.39 0.431 . . . . 0.0 110.417 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.78 -46.12 88.26 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.802 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -57.71 -63.45 1.24 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.835 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.502 ' HB ' ' HH ' ' A' ' 65' ' ' TYR . 14.9 t -60.17 -39.29 85.9 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.7 t -71.74 -47.54 53.1 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.074 -174.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.402 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 15.9 m-20 -71.73 -54.2 11.05 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.72 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 C--N 1.317 -0.834 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -171.365 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.727 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 21.3 ttt . . . . . 0 N--CA 1.441 -0.886 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.515 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 42.9 mt-10 -57.71 -26.74 62.19 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 26.0 m -66.88 -49.11 66.68 Favored 'General case' 0 C--O 1.26 1.614 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.975 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.9 pp -71.12 -28.06 31.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.834 0.826 . . . . 0.0 110.183 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.537 ' CG2' HD12 ' A' ' 26' ' ' ILE . 12.1 mm -67.79 -44.48 85.58 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.252 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.138 174.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -60.62 -39.1 86.97 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 22.9 t -61.24 -50.63 72.28 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.66 -53.16 61.24 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.454 1.101 . . . . 0.0 112.588 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.494 HD11 ' N ' ' B' ' 150' ' ' MET . 3.7 pp -72.71 -31.18 64.8 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -173.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' MET . . . . . 0.494 ' N ' HD11 ' B' ' 149' ' ' LEU . 49.5 tpp . . . . . 0 C--N 1.315 -0.899 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.454 -174.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.37 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.519 ' CD2' ' HA ' ' A' ' 60' ' ' SER . 62.4 p-90 -63.98 -17.84 63.68 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.545 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 20.7 p80 -69.35 -13.47 62.39 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.876 -177.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -89.61 -2.98 58.48 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.485 0.659 . . . . 0.0 109.788 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -95.62 -13.17 24.56 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.528 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.597 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -104.77 110.77 31.79 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.722 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.8 m -73.3 149.61 42.55 Favored 'General case' 0 C--N 1.279 -2.459 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -38.48 72.08 Favored 'General case' 0 C--O 1.209 -1.049 0 O-C-N 123.556 0.535 . . . . 0.0 109.654 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.89 -29.02 68.02 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.64 -52.97 9.33 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.443 ' O ' HG22 ' A' ' 19' ' ' VAL . 5.2 ptm180 -58.66 -41.79 86.92 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.178 176.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.5 t -69.21 -25.4 64.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.434 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 15.2 t60 -67.98 -38.95 83.31 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -37.72 82.38 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.811 177.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 15' ' ' ARG . 98.2 t -57.04 -47.87 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-O 121.548 0.69 . . . . 0.0 109.384 174.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.434 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.2 t-80 -53.93 -50.66 65.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.503 176.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.486 ' CD ' HD23 ' B' ' 115' ' ' LEU . 54.8 mttm -64.6 -37.11 86.45 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.6 mt -55.58 -43.92 76.4 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.342 0.401 . . . . 0.0 109.941 176.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.425 HG23 ' HB3' ' A' ' 43' ' ' LEU . 2.3 t -60.08 -53.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 123.684 0.615 . . . . 0.0 111.905 175.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -65.48 -27.53 68.56 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.817 0.341 . . . . 0.0 111.624 -176.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.445 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -81.33 -43.2 19.41 Favored 'General case' 0 N--CA 1.424 -1.765 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.947 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.526 HD13 ' CG2' ' B' ' 145' ' ' ILE . 1.8 tt -70.22 -39.93 77.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.405 0 CA-C-O 121.606 0.717 . . . . 0.0 109.66 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.428 ' CD2' ' HD3' ' A' ' 39' ' ' ARG . 4.4 m-85 -125.66 102.29 29.28 Favored Pre-proline 0 N--CA 1.401 -2.887 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.759 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.86 140.89 22.59 Favored 'Trans proline' 0 N--CA 1.438 -1.766 0 C-N-CA 123.294 2.663 . . . . 0.0 111.347 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.45 109.92 63.49 Favored Pre-proline 0 N--CA 1.382 -3.847 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.481 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.07 -26.92 4.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 121.92 1.747 . . . . 0.0 110.622 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -156.42 143.23 13.46 Favored Pre-proline 0 N--CA 1.433 -1.322 0 N-CA-C 106.22 -1.77 . . . . 0.0 106.22 -176.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.91 -21.82 42.87 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.612 2.208 . . . . 0.0 113.761 176.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -18.02 63.64 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.561 -0.712 . . . . 0.0 112.306 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.3 -14.76 63.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.652 0.739 . . . . 0.0 110.173 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 40' ' ' MET . 13.2 mt -91.32 1.78 56.86 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.569 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -133.16 14.91 4.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 122.076 0.941 . . . . 0.0 109.677 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.624 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 21.3 t70 -79.38 174.29 11.72 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.302 179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.624 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -25.89 63.01 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.543 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.428 ' HD3' ' CD2' ' A' ' 27' ' ' PHE . 23.9 ttm180 -61.03 -27.87 68.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.624 175.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.515 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 11.1 tpp -62.75 -42.49 99.7 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.773 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.54 -33.31 72.49 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 119.589 -0.844 . . . . 0.0 109.689 -176.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -71.97 -45.54 60.63 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.454 1.101 . . . . 0.0 110.479 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.425 ' HB3' HG23 ' A' ' 23' ' ' VAL . 95.5 mt -67.31 -45.32 76.81 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.327 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.502 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -72.83 -32.19 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 C-N-CA 120.534 -0.467 . . . . 0.0 110.239 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.89 -43.67 98.37 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.544 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.2 t80 -61.47 -51.45 68.61 Favored 'General case' 0 C--O 1.208 -1.085 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.975 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.24 87.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.629 0.252 . . . . 0.0 111.334 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -64.8 -42.64 94.88 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.4 pttp -70.5 -35.59 73.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.272 0.558 . . . . 0.0 110.208 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.42 HG21 ' O ' ' A' ' 46' ' ' TYR . 54.6 t -65.32 -49.68 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.162 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -55.43 -51.9 65.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.271 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.34 -38.85 91.66 Favored Glycine 0 C--N 1.333 0.393 0 O-C-N 123.642 0.589 . . . . 0.0 112.975 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.14 -54.12 45.68 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.254 0.55 . . . . 0.0 111.054 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.425 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.2 ptp -69.49 -27.82 65.53 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.545 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 57.7 t80 -62.47 -54.14 44.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.92 -17.81 60.5 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.184 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.0 t -79.72 -19.64 48.36 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 120.741 0.305 . . . . 0.0 110.96 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.48 165.25 12.09 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -175.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.43 6.12 37.46 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.284 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.519 ' HA ' ' CD2' ' A' ' 6' ' ' TRP . 7.2 t -173.59 162.66 4.21 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.597 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.95 -30.37 71.35 Favored 'General case' 0 C--O 1.168 -3.197 0 O-C-N 123.804 0.69 . . . . 0.0 110.77 178.18 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.12 -47.39 78.21 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.891 0.853 . . . . 0.0 109.543 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -71.6 -43.8 65.58 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.494 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -40.12 94.93 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.623 ' CE1' HD13 ' B' ' 115' ' ' LEU . 5.1 t80 -60.6 -47.05 87.93 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.207 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.618 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 40.5 t-80 -63.35 -53.76 47.5 Favored 'General case' 0 C--O 1.205 -1.253 0 O-C-N 123.716 0.635 . . . . 0.0 111.524 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.87 -30.47 69.84 Favored 'General case' 0 C--O 1.256 1.43 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.167 -174.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.425 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.23 -44.05 63.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 174.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -52.95 -33.0 48.91 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.394 0.678 . . . . 0.0 111.717 173.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 31.3 mt-10 -73.38 -44.63 58.17 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.549 0.214 . . . . 0.0 110.845 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' HD11 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.12 -37.74 78.49 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 118.687 -1.205 . . . . 0.0 110.509 -179.432 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.616 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -36.77 77.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.548 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.8 -54.29 36.19 Favored 'General case' 0 C--O 1.258 1.527 0 C-N-CA 124.505 1.122 . . . . 0.0 110.379 174.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.7 ptpt -69.36 -31.82 70.49 Favored 'General case' 0 C--O 1.204 -1.334 0 O-C-N 123.8 0.688 . . . . 0.0 110.771 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.47 ' HA ' ' HE3' ' B' ' 141' ' ' MET . 1.3 mp -63.15 -46.93 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 O-C-N 123.389 0.431 . . . . 0.0 109.955 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 52.5 mt-30 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.699 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.588 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -74.07 -28.22 61.28 Favored 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.421 -176.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -62.49 -52.79 62.1 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.651 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -62.03 -44.54 96.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.927 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.3 OUTLIER -62.63 -53.63 51.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.698 -178.099 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.3 pt-20 -76.35 -34.77 58.95 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.88 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.029 -178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.435 -1.186 0 CA-C-O 121.244 0.545 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.54 -40.45 85.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.866 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . 0.427 ' HA ' HD11 ' B' ' 115' ' ' LEU . 25.0 mt-30 -64.52 -39.32 93.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.575 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.92 -50.96 68.79 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.647 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -42.23 90.94 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 123.166 0.291 . . . . 0.0 111.386 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.623 HD13 ' CE1' ' A' ' 65' ' ' TYR . 16.7 mt -51.44 -63.04 1.26 Allowed 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.643 0.59 . . . . 0.0 110.58 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 12.9 m -65.96 -28.48 68.93 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.495 -1.229 . . . . 0.0 112.298 -172.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.0 m -68.3 -40.66 81.66 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 120.631 -0.428 . . . . 0.0 109.957 176.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -76.15 -47.85 22.76 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.659 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 60.7 p . . . . . 0 C--N 1.321 -0.66 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.235 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.651 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.8 ttt . . . . . 0 N--CA 1.436 -1.155 0 CA-C-O 121.436 0.636 . . . . 0.0 111.436 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 13.4 tm-20 -56.55 -27.01 56.61 Favored 'General case' 0 C--O 1.2 -1.546 0 C-N-CA 124.096 0.958 . . . . 0.0 112.422 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 21.7 t -62.27 -49.95 73.65 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-N 117.97 0.35 . . . . 0.0 110.755 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.412 HD12 ' CG ' ' B' ' 141' ' ' MET 0.261 2.7 pp -70.29 -24.88 26.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.201 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.905 176.364 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.526 ' CG2' HD13 ' A' ' 26' ' ' ILE . 16.9 mm -63.13 -43.16 98.74 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.398 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 78.0 mtp180 -56.84 -45.1 82.59 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.304 0.641 . . . . 0.0 110.625 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 6.1 p -60.11 -36.64 77.91 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 119.542 -0.863 . . . . 0.0 113.255 176.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -76.11 -44.95 36.16 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.231 -0.988 . . . . 0.0 112.295 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.436 HD12 ' N ' ' B' ' 150' ' ' MET 0.262 3.1 pp -70.24 -33.55 71.78 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.211 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' MET . . . . . 0.436 ' N ' HD12 ' B' ' 149' ' ' LEU . 50.5 ttm . . . . . 0 C--N 1.321 -0.657 0 CA-C-O 121.242 0.544 . . . . 0.0 111.039 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.506 0 N-CA-C 116.156 1.223 . . . . 0.0 116.156 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -76.01 -2.14 29.15 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 117.48 0.64 . . . . 0.0 112.087 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -62.53 -21.33 65.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.449 0.642 . . . . 0.0 110.793 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -86.2 -10.55 54.49 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.809 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -102.85 5.21 38.47 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.867 0.841 . . . . 0.0 110.09 -177.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.526 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.3 p -129.31 110.79 21.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.5 m -83.22 151.04 25.84 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.456 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.8 56.98 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.934 0.894 . . . . 0.0 111.33 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -69.73 -30.05 67.56 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -74.76 -47.69 29.71 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 -177.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.534 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.4 ptm180 -64.93 -41.25 95.7 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.621 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 t -69.6 -25.35 63.92 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.592 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 15.6 t60 -75.31 -36.86 61.04 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.888 177.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.455 HD21 HD21 ' A' ' 68' ' ' LEU . 1.4 mp -63.29 -37.63 87.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 173.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 15' ' ' ARG . 99.5 t -60.21 -45.78 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -55.77 -47.04 77.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.881 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -66.49 -39.21 88.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.78 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.401 ' O ' HG23 ' A' ' 26' ' ' ILE . 28.8 mt -53.47 -48.35 68.94 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 123.547 0.529 . . . . 0.0 109.799 173.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 40' ' ' MET . 53.8 t -54.67 -48.64 71.72 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 O-C-N 124.237 0.96 . . . . 0.0 111.612 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -69.37 -24.19 63.85 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -44.55 16.24 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.503 175.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.665 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.09 -29.61 37.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.958 0.885 . . . . 0.0 109.517 -177.743 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -123.46 84.62 52.65 Favored Pre-proline 0 N--CA 1.403 -2.822 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.899 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.87 115.95 2.68 Favored 'Trans proline' 0 N--CA 1.443 -1.468 0 C-N-CA 122.396 2.064 . . . . 0.0 109.072 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.47 118.05 67.92 Favored Pre-proline 0 N--CA 1.394 -3.225 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -168.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -78.92 -25.31 6.28 Favored 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 121.698 1.599 . . . . 0.0 109.537 172.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -167.42 145.43 4.0 Favored Pre-proline 0 CA--C 1.506 -0.731 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.23 -22.95 74.97 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.851 2.367 . . . . 0.0 114.167 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.19 -5.91 53.24 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.029 -1.044 . . . . 0.0 111.778 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.42 -8.36 59.05 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 40' ' ' MET . 28.6 mt -89.55 7.09 38.07 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.55 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -132.68 22.12 4.27 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.197 0.998 . . . . 0.0 108.944 177.186 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.589 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.3 t70 -95.61 172.68 7.91 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.058 -176.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -22.84 64.86 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 122.794 0.437 . . . . 0.0 111.476 -178.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -79.05 -17.16 55.73 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.713 0.768 . . . . 0.0 109.416 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.589 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.3 tpp -62.98 -43.14 99.6 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.124 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -56.04 -38.84 71.12 Favored 'General case' 0 C--O 1.193 -1.873 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.082 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.416 HD22 HD22 ' B' ' 149' ' ' LEU . 2.8 t30 -68.09 -45.0 74.99 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.782 0.833 . . . . 0.0 111.546 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 37.4 mt -67.89 -43.44 79.31 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.184 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 p -73.25 -33.22 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.263 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.07 -44.05 97.51 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.517 0.675 . . . . 0.0 109.392 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.665 ' CE1' HG13 ' A' ' 26' ' ' ILE . 3.9 t80 -61.0 -47.19 87.59 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.263 174.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.13 97.32 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.501 -177.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -63.03 -46.3 88.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.898 176.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 19.7 pttp -64.06 -39.13 93.4 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 121.021 0.439 . . . . 0.0 110.528 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.58 -50.39 66.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.134 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -57.01 -47.79 80.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.719 0.807 . . . . 0.0 109.896 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -42.83 93.66 Favored Glycine 0 N--CA 1.446 -0.682 0 O-C-N 123.666 0.603 . . . . 0.0 112.632 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.35 -54.11 50.53 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.368 0.604 . . . . 0.0 110.564 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.517 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 ptp -67.16 -33.14 74.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.61 -50.96 71.86 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.01 -18.01 60.91 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.842 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -75.58 -54.52 6.87 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 122.374 0.269 . . . . 0.0 111.446 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.53 168.32 7.58 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.19 9.29 15.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.027 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.415 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 73.2 m -161.15 153.81 20.66 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 175.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.526 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.39 -39.58 74.46 Favored 'General case' 0 C--O 1.182 -2.472 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.461 -177.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.415 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 2.8 p-10 -62.78 -32.47 73.64 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 124.545 1.138 . . . . 0.0 109.479 176.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -71.96 -46.72 56.4 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.156 174.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.45 99.17 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.58 -49.06 77.63 Favored 'General case' 0 C--O 1.196 -1.731 0 C-N-CA 125.235 1.414 . . . . 0.0 109.381 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -66.12 -48.39 71.0 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 122.535 0.334 . . . . 0.0 111.669 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 3.8 pp -69.35 -29.96 67.88 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.642 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -75.93 -37.41 58.75 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.465 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -62.04 -35.93 80.09 Favored 'General case' 0 C--O 1.204 -1.317 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 7.2 mm-40 -59.89 -52.04 67.13 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.803 0.841 . . . . 0.0 110.263 172.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.73 -47.74 84.46 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.398 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.598 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.3 tt -68.16 -37.23 77.8 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.157 -177.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.506 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 13.0 t80 -56.88 -54.11 50.28 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 125.269 1.428 . . . . 0.0 111.395 176.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.4 ptpt -66.23 -32.28 73.61 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.411 -177.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.46 -39.54 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.684 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.0 mt-30 -66.2 -46.45 77.25 Favored 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.922 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.642 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.1 ptpt -75.2 -27.99 59.82 Favored 'General case' 0 N--CA 1.401 -2.92 0 C-N-CA 119.41 -0.916 . . . . 0.0 112.369 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 10.5 tp10 -57.54 -52.89 63.57 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.516 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -66.59 -41.55 88.33 Favored 'General case' 0 C--O 1.25 1.101 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.77 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.423 ' N ' HD13 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -60.77 -53.8 52.92 Favored 'General case' 0 N--CA 1.416 -2.165 0 C-N-CA 123.251 0.62 . . . . 0.0 110.433 -177.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -73.35 -32.31 64.46 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -175.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.245 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.442 -0.852 0 CA-C-O 121.476 0.655 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.57 -45.94 56.77 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.845 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.48 -42.94 97.31 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.24 -47.6 79.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.426 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.98 -44.16 82.4 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.75 0.656 . . . . 0.0 109.624 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.48 -60.62 3.5 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.867 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 17.5 m -57.05 -48.79 77.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.86 0.362 . . . . 0.0 111.837 -173.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 m -69.94 -52.61 23.03 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.047 -174.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.18 -40.88 59.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.566 -174.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.592 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 33.1 t . . . . . 0 N--CA 1.464 0.262 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.531 ' SD ' HD12 ' B' ' 144' ' ' ILE . 14.5 tpt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.469 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.0 mt-10 -48.98 -26.86 2.76 Favored 'General case' 0 C--O 1.187 -2.234 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 177.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.4 m -62.04 -60.33 3.77 Favored 'General case' 0 C--O 1.27 2.134 0 CA-C-N 119.391 0.996 . . . . 0.0 111.249 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.531 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.7 pp -72.53 -25.53 22.95 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 CA-C-O 122.492 1.139 . . . . 0.0 110.532 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' B' ' 149' ' ' LEU . 5.9 mm -70.48 -37.58 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.093 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.431 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.483 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 32.3 ttm180 -64.32 -36.55 84.48 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 m -57.83 -49.02 78.08 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.186 173.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -68.62 -41.63 79.21 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -77.27 -20.41 55.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--N 1.321 -0.632 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.743 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.373 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -75.74 -18.56 59.52 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.389 19.6 p80 -72.32 -0.52 12.53 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -174.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -90.56 -6.32 54.85 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.152 0.501 . . . . 0.0 109.878 173.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -106.72 11.99 29.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.206 0.527 . . . . 0.0 112.136 -176.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.46 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.7 p -129.05 109.9 19.67 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 CA-C-O 122.119 0.961 . . . . 0.0 109.51 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.0 m -73.87 150.74 40.75 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.842 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -38.36 84.64 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -61.29 -37.25 82.5 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.592 176.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -73.35 -45.51 54.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.4 ptm180 -70.41 -43.35 70.16 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.199 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.4 t -65.77 -28.07 68.75 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -64.97 -48.22 74.78 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -38.75 85.57 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.823 177.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.541 HG22 ' O ' ' A' ' 15' ' ' ARG . 95.0 t -57.46 -47.34 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.121 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.528 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.2 t-80 -62.98 -38.65 92.0 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.798 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.9 -35.6 77.04 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 119.11 -1.036 . . . . 0.0 111.538 175.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.58 -42.29 78.42 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.5 t -58.59 -50.25 79.67 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.713 173.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.4 mt-30 -62.52 -30.49 71.33 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.856 0.36 . . . . 0.0 111.64 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.35 -43.42 21.17 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.407 HG13 HG12 ' B' ' 145' ' ' ILE . 3.1 tt -70.68 -32.96 51.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.953 0.882 . . . . 0.0 109.62 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.426 ' HE1' ' NH1' ' A' ' 39' ' ' ARG . 79.1 t80 -125.37 84.96 59.13 Favored Pre-proline 0 N--CA 1.407 -2.594 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.531 -176.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -59.66 85.38 0.07 OUTLIER 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 123.073 2.516 . . . . 0.0 108.804 168.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -63.75 140.61 97.85 Favored Pre-proline 0 N--CA 1.424 -1.744 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -170.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.4 -21.19 6.52 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.945 2.43 . . . . 0.0 111.532 174.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -153.68 135.16 8.75 Favored Pre-proline 0 CA--C 1.505 -0.759 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -53.47 -24.25 27.68 Favored 'Trans proline' 0 CA--C 1.558 1.713 0 C-N-CA 122.726 2.284 . . . . 0.0 113.812 175.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.15 -14.7 59.36 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.826 -0.546 . . . . 0.0 111.68 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.66 -10.95 59.87 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.934 0.873 . . . . 0.0 109.494 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.2 mt -85.32 3.01 41.66 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.371 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -132.76 15.18 4.36 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.762 0.792 . . . . 0.0 110.052 177.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.559 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.3 t70 -74.93 175.63 7.91 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.947 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.557 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.06 -21.66 62.22 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.477 0.656 . . . . 0.0 110.417 178.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.426 ' NH1' ' HE1' ' A' ' 27' ' ' PHE . 60.0 ttt180 -75.52 -16.0 60.33 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.567 0.699 . . . . 0.0 109.2 176.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.65 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.58 -40.9 93.26 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.456 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -58.48 -32.13 68.48 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.233 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -72.02 -49.67 34.93 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 124.27 1.028 . . . . 0.0 110.774 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.71 -43.32 84.65 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.867 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.65 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -73.36 -28.05 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -61.25 -49.93 75.09 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.409 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -57.83 -46.16 85.13 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.998 175.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.31 90.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.512 0.196 . . . . 0.0 111.456 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -63.17 -44.62 94.93 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.205 0.602 . . . . 0.0 112.182 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.1 pttp -68.22 -36.95 80.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.188 0.518 . . . . 0.0 110.111 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.2 t -66.99 -47.72 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.612 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -55.52 -49.79 71.7 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.655 0.782 . . . . 0.0 108.999 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.44 84.84 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.922 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.12 -54.69 22.39 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.617 -0.343 . . . . 0.0 110.728 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.453 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.8 OUTLIER -66.78 -27.53 67.66 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.449 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.33 -53.75 47.73 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -67.7 -34.31 76.62 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.35 0.595 . . . . 0.0 111.574 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.453 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 33.8 m -68.53 -24.51 64.66 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.31 161.25 14.76 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -107.5 5.4 27.11 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.65 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.8 p -163.98 157.53 18.59 Favored 'General case' 0 CA--C 1.477 -1.833 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.46 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.27 -28.55 63.19 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.126 -178.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -67.06 -40.11 87.03 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -64.17 -45.27 89.15 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.463 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -43.6 92.95 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.889 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.67 ' CE1' HD12 ' B' ' 115' ' ' LEU . 10.9 t80 -60.68 -47.43 86.29 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.505 1.122 . . . . 0.0 109.944 178.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -63.38 -50.58 69.33 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 pp -70.55 -30.23 66.9 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.653 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -43.28 69.98 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.475 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -55.34 -41.23 72.21 Favored 'General case' 0 C--O 1.202 -1.418 0 O-C-N 123.795 0.684 . . . . 0.0 110.795 173.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -56.96 -49.66 75.0 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 123.399 0.679 . . . . 0.0 111.718 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.416 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.53 -36.3 68.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.573 -177.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.7 tt -69.61 -35.69 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.525 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.4 t80 -56.65 -52.5 64.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.975 1.31 . . . . 0.0 110.593 175.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.02 -32.4 73.6 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.375 -177.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -65.37 -43.01 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 O-C-N 123.244 0.34 . . . . 0.0 110.743 177.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.9 mt-30 -63.06 -52.71 61.71 Favored 'General case' 0 CA--C 1.491 -1.311 0 O-C-N 123.757 0.661 . . . . 0.0 110.679 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.595 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.8 ptpt -72.39 -27.93 62.68 Favored 'General case' 0 N--CA 1.409 -2.493 0 C-N-CA 119.184 -1.006 . . . . 0.0 112.908 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 40.4 tp10 -57.48 -52.89 63.56 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.1 -43.18 75.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.591 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -61.63 -52.93 62.32 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.595 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.9 pt-20 -71.46 -32.67 68.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.411 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.198 0.523 . . . . 0.0 110.458 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.549 0.91 0 CA-C-O 120.818 0.342 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.41 -45.65 53.31 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.688 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -64.22 -40.81 96.81 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.096 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.36 -40.85 85.8 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.634 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 67.8 tp -56.28 -53.69 54.2 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.67 HD12 ' CE1' ' A' ' 65' ' ' TYR . 26.4 mt -51.59 -65.24 0.59 Allowed 'General case' 0 C--O 1.205 -1.261 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.274 176.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.7 m -59.37 -31.8 69.55 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.96 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 56.7 m -69.1 -47.89 63.99 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.124 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -76.5 -34.41 58.61 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.868 -176.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 66.7 p . . . . . 0 C--O 1.243 0.74 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -174.949 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.501 ' SD ' HD12 ' B' ' 144' ' ' ILE . 9.7 tpt . . . . . 0 CA--C 1.552 1.021 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -54.78 -25.82 30.57 Favored 'General case' 0 C--O 1.194 -1.823 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.5 p -63.57 -59.82 4.13 Favored 'General case' 0 C--O 1.265 1.914 0 CA-C-N 119.54 1.064 . . . . 0.0 110.859 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.501 HD12 ' SD ' ' B' ' 141' ' ' MET . 9.0 pt -61.92 -35.41 67.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.736 0.779 . . . . 0.0 109.911 176.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.415 ' O ' ' HG ' ' B' ' 149' ' ' LEU . 1.4 mp -67.91 -34.29 66.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.069 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -65.18 -47.53 76.64 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 8.8 p -63.53 -33.91 76.64 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.987 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -80.68 -35.64 33.39 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -74.49 -23.59 58.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.023 0.374 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 59.7 ttp . . . . . 0 N--CA 1.463 0.213 0 O-C-N 123.976 0.797 . . . . 0.0 109.605 176.849 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.536 0 N-CA-C 115.052 0.781 . . . . 0.0 115.052 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -73.27 -9.13 58.38 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 117.392 0.596 . . . . 0.0 111.309 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -57.62 -21.94 42.46 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 121.475 0.655 . . . . 0.0 112.099 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.8 -19.51 58.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.557 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.57 4.07 54.31 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.716 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.535 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -130.64 109.48 17.05 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 178.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 m -74.86 154.36 38.27 Favored 'General case' 0 N--CA 1.413 -2.279 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -38.37 56.91 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.718 0.636 . . . . 0.0 110.261 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.669 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 13.9 t70 -60.41 -44.04 96.11 Favored 'General case' 0 C--O 1.179 -2.64 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.684 177.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.1 tm? -67.68 -51.58 47.98 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -171.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.554 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.5 ptm180 -60.38 -45.73 92.49 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.071 177.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -68.02 -22.25 64.98 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.953 0.882 . . . . 0.0 109.584 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.705 ' NE2' ' HA ' ' B' ' 119' ' ' SER . 2.1 t60 -71.61 -43.03 66.93 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.836 -1.074 . . . . 0.0 108.434 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.554 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -68.56 -33.6 74.37 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.735 176.013 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 15' ' ' ARG . 92.9 t -56.37 -48.14 80.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 O-C-N 123.773 0.671 . . . . 0.0 109.656 176.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.431 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 18.4 t-80 -66.2 -36.92 84.31 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.594 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HZ3' ' CD2' ' A' ' 17' ' ' HIS . 13.8 mptt -66.56 -35.24 79.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.89 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.412 HD11 ' HA ' ' A' ' 19' ' ' VAL . 80.8 mt -56.23 -46.04 79.7 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 175.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.9 t -57.32 -50.91 75.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 O-C-N 124.052 0.845 . . . . 0.0 111.165 173.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 68.6 mt-30 -60.57 -32.66 71.74 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -78.33 -46.18 20.75 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.959 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.555 HD12 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -70.28 -35.21 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.868 0.842 . . . . 0.0 109.621 -177.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.01 90.78 48.57 Favored Pre-proline 0 N--CA 1.402 -2.844 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.89 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.98 95.14 0.24 Allowed 'Trans proline' 0 N--CA 1.443 -1.484 0 C-N-CA 121.788 1.659 . . . . 0.0 108.207 174.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' HB1' ' A' ' 34' ' ' ALA . 9.9 t -68.87 136.36 89.91 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.798 -170.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.82 -25.36 10.7 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.213 2.608 . . . . 0.0 111.482 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -149.15 144.49 18.07 Favored Pre-proline 0 CA--C 1.49 -1.361 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.41 -13.45 33.0 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.286 1.991 . . . . 0.0 112.575 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.99 -9.33 58.75 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.0 -0.438 . . . . 0.0 111.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.433 ' HB1' ' OG1' ' A' ' 29' ' ' THR . . . -79.76 -12.24 59.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.884 0.85 . . . . 0.0 109.034 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.3 mt -85.36 5.98 28.43 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.944 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.03 20.66 4.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.626 0.727 . . . . 0.0 109.736 177.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.599 ' O ' ' HB3' ' A' ' 40' ' ' MET . 23.4 t70 -81.65 175.94 10.06 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.85 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.56 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -71.17 -29.82 65.66 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.891 -0.506 . . . . 0.0 111.252 174.256 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -66.16 -23.45 66.47 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.945 0.879 . . . . 0.0 109.158 177.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.634 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -60.38 -36.78 78.88 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.951 176.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.8 pt-20 -61.46 -37.29 83.05 Favored 'General case' 0 C--O 1.2 -1.542 0 C-N-CA 118.444 -1.302 . . . . 0.0 109.672 -178.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -70.7 -43.04 69.84 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.727 0.811 . . . . 0.0 111.17 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.28 -43.82 73.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.641 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.634 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.3 p -73.3 -30.83 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.11 87.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 175.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.488 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.4 t80 -59.41 -46.78 87.74 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.546 175.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.39 -44.9 93.4 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.182 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -64.11 -42.8 96.74 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 122.938 0.495 . . . . 0.0 111.869 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 35.9 pttt -67.98 -40.13 83.18 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 -178.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.442 ' O ' ' HG2' ' A' ' 54' ' ' MET . 37.7 t -64.15 -50.47 76.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.933 178.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -56.19 -48.5 76.27 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.983 0.802 . . . . 0.0 109.24 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.86 96.28 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.079 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -60.25 -54.31 47.23 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.403 0.62 . . . . 0.0 110.034 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.462 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 ptp -67.76 -31.21 70.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.24 -35.72 80.13 Favored 'General case' 0 C--O 1.202 -1.432 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -20.57 37.3 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 121.296 -0.877 . . . . 0.0 111.748 177.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.3 t -80.65 -49.01 11.8 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.54 164.49 13.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -102.57 -5.01 24.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.988 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.2 m -157.81 154.17 27.64 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.535 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -63.6 -33.55 75.86 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.493 178.363 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -56.31 -47.49 78.59 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.44 0.638 . . . . 0.0 109.536 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.71 -45.03 80.05 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.753 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -41.01 98.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.626 ' CE1' HD11 ' B' ' 115' ' ' LEU . 8.5 t80 -63.19 -48.47 78.21 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.336 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.561 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m80 -67.25 -44.8 78.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 pp -70.27 -30.57 67.63 Favored 'General case' 0 C--O 1.254 1.341 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.157 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.462 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.27 -41.09 67.12 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.458 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -58.3 -35.09 71.32 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.616 0.767 . . . . 0.0 111.57 176.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 32.3 mm-40 -70.08 -42.86 72.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.055 0.455 . . . . 0.0 111.122 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.594 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.54 -39.51 70.64 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.723 -179.327 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.609 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -67.29 -34.64 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 2.7 t80 -53.75 -50.88 65.03 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 124.856 1.263 . . . . 0.0 110.756 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.0 ptpt -66.73 -33.66 76.13 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.5 0.5 . . . . 0.0 110.77 -176.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.31 -45.35 98.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.6 mt-30 -59.71 -46.52 88.85 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.777 -176.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -79.03 -27.01 43.16 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -59.97 -46.08 90.6 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.694 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.2 pp -68.81 -40.65 79.43 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.127 178.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 47.3 mt-10 -55.57 -52.75 62.7 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 121.11 0.481 . . . . 0.0 110.818 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.3 pt-20 -67.1 -39.38 86.7 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.206 -176.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.775 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.344 -178.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.443 -0.804 0 CA-C-O 121.054 0.454 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.13 -41.81 70.03 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -67.98 -40.92 83.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.33 -178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.84 -47.99 83.86 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.585 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 tt -55.54 -49.77 71.79 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.626 HD11 ' CE1' ' A' ' 65' ' ' TYR . 51.8 mt -55.89 -67.54 0.28 Allowed 'General case' 0 C--O 1.21 -1.025 0 O-C-N 124.287 0.992 . . . . 0.0 111.451 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 22.5 m -58.82 -38.33 78.42 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.694 -169.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.8 m -69.76 -51.77 31.15 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.047 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.54 -33.63 58.55 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.517 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.705 ' HA ' ' NE2' ' A' ' 17' ' ' HIS . 22.6 t . . . . . 0 C--O 1.246 0.894 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.694 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.0 ttt . . . . . 0 N--CA 1.446 -0.654 0 CA-C-O 120.383 0.135 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.53 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.9 mt-10 -54.48 -27.18 36.0 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -61.32 -51.0 70.66 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.013 0.435 . . . . 0.0 110.668 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -75.34 -24.35 17.38 Favored 'Isoleucine or valine' 0 C--O 1.249 1.049 0 CA-C-O 122.015 0.912 . . . . 0.0 110.764 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.555 ' CG2' HD12 ' A' ' 26' ' ' ILE . 16.1 mm -65.94 -42.24 91.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.776 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -60.37 -40.17 89.87 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 123.861 0.864 . . . . 0.0 108.906 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.2 m -56.12 -45.93 79.33 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 123.553 0.533 . . . . 0.0 110.017 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -71.02 -50.07 38.12 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.2 pp -71.69 -31.5 66.83 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -173.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' MET . . . . . 0.439 ' N ' HD11 ' B' ' 149' ' ' LEU . 16.4 tpt . . . . . 0 C--N 1.309 -1.188 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.215 0 N-CA-C 115.679 1.032 . . . . 0.0 115.679 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -69.51 -11.27 60.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 117.601 0.701 . . . . 0.0 111.094 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.41 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 8.2 p80 -60.23 -23.03 63.73 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.936 0.398 . . . . 0.0 111.471 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -79.88 -6.55 57.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.3 0.572 . . . . 0.0 110.512 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -101.05 9.56 42.01 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.788 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.592 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -126.19 111.28 26.05 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.265 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 177.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -73.19 150.16 42.33 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.65 -37.99 59.54 Favored 'General case' 0 N--CA 1.441 -0.892 0 O-C-N 123.798 0.686 . . . . 0.0 110.075 176.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 12.4 m-20 -53.17 -44.75 68.11 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 175.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.6 ' O ' HD21 ' A' ' 18' ' ' LEU . 3.4 tm? -72.57 -54.14 9.99 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 -170.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.481 ' O ' HG21 ' A' ' 19' ' ' VAL . 2.1 ptm180 -59.79 -45.27 92.81 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 t -69.68 -25.56 63.95 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.484 0.659 . . . . 0.0 109.947 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.644 ' CE1' ' HA ' ' B' ' 119' ' ' SER . 19.5 t60 -65.92 -46.53 77.88 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.219 176.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.6 HD21 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -65.87 -34.5 78.29 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.259 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 15' ' ' ARG . 95.4 t -55.35 -47.32 78.14 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 CA-C-O 121.33 0.586 . . . . 0.0 109.736 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.48 -37.37 82.8 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.145 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.611 ' HZ2' ' CE1' ' A' ' 17' ' ' HIS . 12.6 mptt -64.54 -37.62 88.18 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.802 175.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 94.1 mt -56.67 -45.08 81.91 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.4 -53.84 43.26 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 O-C-N 123.508 0.505 . . . . 0.0 110.491 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.4 ' OE1' HD23 ' A' ' 35' ' ' LEU . 13.2 mm100 -53.22 -34.72 58.27 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -79.32 -46.15 18.25 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.567 HD13 ' CG2' ' B' ' 145' ' ' ILE . 5.5 tt -71.07 -33.25 50.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.311 0.577 . . . . 0.0 110.708 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -124.25 95.4 43.63 Favored Pre-proline 0 N--CA 1.409 -2.516 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.808 -176.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -62.37 109.56 0.88 Allowed 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.478 2.118 . . . . 0.0 110.414 173.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.82 119.58 76.15 Favored Pre-proline 0 N--CA 1.397 -3.091 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.6 -15.19 11.11 Favored 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 122.398 2.065 . . . . 0.0 110.844 176.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.13 143.31 4.4 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -59.88 -21.0 62.41 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.251 1.967 . . . . 0.0 113.346 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.13 -10.91 60.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.49 -0.756 . . . . 0.0 111.393 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.8 -13.93 59.97 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.682 0.753 . . . . 0.0 110.054 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.442 ' O ' ' HG2' ' A' ' 40' ' ' MET . 7.7 mt -88.41 5.34 42.72 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.172 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -133.66 20.42 3.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.892 0.854 . . . . 0.0 109.537 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.64 ' O ' ' HB3' ' A' ' 40' ' ' MET . 13.7 t70 -80.58 172.91 13.15 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.865 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.585 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -72.06 -26.48 62.2 Favored 'General case' 0 C--N 1.309 -1.172 0 O-C-N 121.592 -0.693 . . . . 0.0 110.455 175.259 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -67.57 -25.8 65.97 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.64 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 3.0 tpp -59.92 -41.14 91.08 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.902 -1.044 . . . . 0.0 112.248 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -64.94 -27.9 69.15 Favored 'General case' 0 C--O 1.206 -1.229 0 C-N-CA 118.648 -1.221 . . . . 0.0 109.916 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -74.03 -45.08 51.97 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.117 0.967 . . . . 0.0 110.337 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.99 -41.38 77.92 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.711 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.538 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.7 p -73.49 -30.47 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.29 -44.13 95.65 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.561 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 7.0 t80 -60.02 -51.09 71.14 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.203 172.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.21 -43.33 87.61 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.021 0.439 . . . . 0.0 111.223 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -66.25 -46.74 76.05 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 123.571 0.749 . . . . 0.0 111.838 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 12.5 pttp -63.79 -37.0 85.73 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 54' ' ' MET . 21.8 t -69.2 -53.15 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.295 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 55' ' ' TYR . 13.5 tm-20 -54.35 -50.5 67.3 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 124.198 0.936 . . . . 0.0 109.718 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.07 99.43 Favored Glycine 0 C--O 1.222 -0.651 0 O-C-N 123.576 0.547 . . . . 0.0 112.441 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -59.38 -52.2 66.64 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.227 0.537 . . . . 0.0 111.374 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 1.5 ptp -71.45 -27.51 63.31 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.41 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 40.9 t80 -64.26 -47.45 79.56 Favored 'General case' 0 C--O 1.206 -1.215 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 176.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -71.89 -25.71 62.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.26 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.5 t -80.84 -24.92 38.1 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.18 168.97 12.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -109.58 4.72 22.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.653 178.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.8 p -168.95 153.47 5.7 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.592 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -64.74 -33.83 76.9 Favored 'General case' 0 C--O 1.189 -2.109 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.812 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.77 -27.25 63.78 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.276 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 6.5 tp10 -75.32 -44.68 44.08 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 173.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -39.38 93.62 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.764 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.718 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 5.2 t80 -65.3 -46.99 78.18 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.069 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -56.4 -57.42 12.38 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 124.2 1.0 . . . . 0.0 111.697 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.9 pp -69.15 -30.32 68.53 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.487 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.52 -39.56 64.7 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.005 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.464 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -59.69 -38.8 82.57 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.091 176.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.69 -44.07 94.77 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.426 ' HB2' ' HZ2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -70.95 -36.85 72.76 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 119.327 -0.949 . . . . 0.0 111.361 -179.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.581 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.2 tt -69.98 -39.35 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.566 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.1 t80 -52.19 -53.29 45.1 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.073 1.349 . . . . 0.0 111.067 174.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -66.33 -34.01 77.02 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.007 -176.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.68 -42.84 93.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 O-C-N 123.426 0.454 . . . . 0.0 111.221 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 47.9 mt-30 -61.21 -48.77 79.99 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 121.414 0.625 . . . . 0.0 110.345 -178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.653 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.7 ptpt -74.93 -27.7 60.31 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.506 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -61.31 -47.78 84.4 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.78 -36.91 76.13 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.465 178.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.7 OUTLIER -61.72 -53.36 57.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.199 0.6 . . . . 0.0 110.96 179.426 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.653 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -73.01 -37.38 66.97 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -176.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.407 ' HD3' ' C ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.589 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.215 -175.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.422 -1.871 0 CA-C-O 120.357 0.122 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.83 -57.81 11.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.614 0.571 . . . . 0.0 112.237 -178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -69.19 -36.67 77.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.611 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -64.71 -47.9 76.63 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.261 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.02 -47.59 85.21 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.439 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.718 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 18.3 mt -51.57 -66.41 0.39 Allowed 'General case' 0 C--O 1.214 -0.771 0 O-C-N 124.131 0.895 . . . . 0.0 111.738 177.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 15.0 t -62.56 -35.54 79.81 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -169.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -76.57 -44.35 35.04 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.304 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -76.14 -27.79 57.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.077 0.465 . . . . 0.0 110.642 -175.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.644 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 19.8 t . . . . . 0 C--N 1.313 -1.009 0 C-N-CA 120.498 -0.481 . . . . 0.0 112.064 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.416 ' O ' HG12 ' B' ' 145' ' ' ILE . 92.1 mmm . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 44.9 mt-10 -47.63 -29.85 3.26 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -173.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 35.0 t -59.3 -59.6 5.2 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 120.878 0.37 . . . . 0.0 110.299 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -70.54 -24.32 25.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.615 0.722 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 13.3 mm -66.45 -49.95 71.19 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.604 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 19.1 mtp180 -66.25 -34.89 79.04 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 120.48 0.181 . . . . 0.0 110.902 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 t -57.22 -43.02 82.43 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 123.935 0.772 . . . . 0.0 109.111 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -77.1 -54.92 5.92 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.188 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.5 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.3 pp -65.17 -26.64 68.25 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 -172.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tpt . . . . . 0 C--N 1.308 -1.238 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.379 -176.468 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.456 0 N-CA-C 115.107 0.803 . . . . 0.0 115.107 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.3 p-90 -67.48 -7.29 24.41 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -55.84 -30.36 61.33 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.024 0.44 . . . . 0.0 111.354 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -75.84 -10.46 59.45 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.046 0.45 . . . . 0.0 111.173 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -106.78 11.98 29.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.205 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.5 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.3 p -128.38 112.2 26.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 121.753 0.787 . . . . 0.0 109.685 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.411 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -74.62 150.07 39.78 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.963 -175.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -41.98 90.01 Favored 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -65.02 -29.4 70.31 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.384 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.498 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.2 tm? -74.41 -52.34 12.37 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 -177.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.546 ' O ' HG21 ' A' ' 19' ' ' VAL . 7.3 ptm180 -65.87 -42.29 90.56 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.57 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -69.68 -25.83 64.08 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.493 ' CD2' ' HB3' ' B' ' 119' ' ' SER . 73.0 t60 -66.73 -45.31 79.07 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 121.41 0.624 . . . . 0.0 109.599 175.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.498 HD11 ' O ' ' A' ' 14' ' ' LEU . 3.7 mp -62.7 -36.8 84.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.232 177.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.546 HG21 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -60.78 -48.75 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.318 0.647 . . . . 0.0 109.65 173.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.465 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 33.0 t-80 -55.12 -45.18 75.54 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.32 0.648 . . . . 0.0 110.767 177.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -66.39 -37.87 86.22 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.871 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.98 -43.16 86.39 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.465 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 18.6 t -54.55 -49.64 64.91 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 C-N-CA 123.964 0.906 . . . . 0.0 111.0 173.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.95 -15.93 61.1 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.655 -0.818 . . . . 0.0 113.112 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.08 -45.67 16.14 Favored 'General case' 0 C--O 1.208 -1.107 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.46 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.539 HD12 ' CG2' ' B' ' 145' ' ' ILE . 3.8 tt -70.53 -30.47 42.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 122.417 1.103 . . . . 0.0 109.885 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -134.85 83.37 41.13 Favored Pre-proline 0 N--CA 1.399 -3.007 0 CA-C-N 114.192 -1.367 . . . . 0.0 107.872 -176.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.78 94.0 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.381 2.054 . . . . 0.0 108.284 170.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 t -63.78 126.99 91.0 Favored Pre-proline 0 N--CA 1.414 -2.263 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.862 -169.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -72.75 -26.4 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.78 2.32 . . . . 0.0 111.298 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.4 142.47 14.62 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.88 -25.14 34.11 Favored 'Trans proline' 0 CA--C 1.554 1.485 0 C-N-CA 122.562 2.175 . . . . 0.0 114.559 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.64 -10.81 59.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.258 -0.902 . . . . 0.0 111.82 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.55 59.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.577 0.703 . . . . 0.0 109.914 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -87.5 0.38 55.64 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.089 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -132.86 34.37 3.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 122.002 0.906 . . . . 0.0 110.681 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.0 t70 -95.32 177.25 5.91 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.454 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.01 -25.67 62.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 121.723 -0.611 . . . . 0.0 109.778 176.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.5 ttm180 -66.24 -24.57 66.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.556 175.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.574 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 6.1 tpp -60.57 -43.74 96.95 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.54 -0.754 . . . . 0.0 112.38 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.423 ' HA ' HG13 ' A' ' 44' ' ' VAL . 11.3 pt-20 -67.56 -26.43 66.3 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 118.603 -1.239 . . . . 0.0 110.297 -177.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.41 ' OD1' HD21 ' B' ' 149' ' ' LEU . 5.5 t30 -73.1 -44.89 59.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.744 177.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 77.6 mt -69.78 -41.03 75.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.578 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.423 HG13 ' HA ' ' A' ' 41' ' ' GLU . 3.6 p -71.77 -28.18 29.98 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.668 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.2 87.04 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.273 0.559 . . . . 0.0 109.545 175.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.0 t80 -60.95 -45.87 92.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.294 174.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.84 97.92 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.418 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -62.56 -45.62 92.11 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.571 0.749 . . . . 0.0 112.225 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.6 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 12.7 pttp -63.91 -37.39 87.21 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.354 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 51.0 t -72.22 -47.71 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.321 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.74 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.12 -45.24 91.41 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.004 0.922 . . . . 0.0 109.863 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.88 -42.15 99.71 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.937 177.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.97 -54.11 50.59 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.376 0.27 . . . . 0.0 111.32 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.476 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -67.23 -30.98 71.03 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.401 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -59.31 -49.59 77.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -77.34 -21.67 53.01 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.324 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -80.97 -35.9 31.54 Favored 'General case' 0 CA--C 1.553 1.075 0 CA-C-O 120.609 0.242 . . . . 0.0 111.498 -178.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.58 167.84 16.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.133 0.492 . . . . 0.0 111.499 -178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -121.83 15.1 10.9 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.639 0.733 . . . . 0.0 110.503 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.5 m -156.0 148.92 24.2 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.5 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -68.04 -39.75 83.0 Favored 'General case' 0 C--O 1.191 -1.997 0 CA-C-O 121.034 0.445 . . . . 0.0 111.542 -179.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -67.71 -32.87 73.81 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 123.627 0.771 . . . . 0.0 108.982 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.56 -48.05 70.89 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.617 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -41.28 98.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.565 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -49.26 77.91 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.819 1.248 . . . . 0.0 109.764 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -64.1 -49.03 73.85 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.62 -30.45 68.18 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.75 -177.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.476 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -74.56 -35.99 63.08 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.62 -31.79 73.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -71.57 -43.2 66.75 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.035 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.404 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -71.41 -36.29 71.29 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.331 -179.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.561 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.4 tt -67.23 -39.78 83.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.468 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.5 t80 -55.24 -54.66 40.61 Favored 'General case' 0 C--O 1.262 1.716 0 C-N-CA 124.491 1.116 . . . . 0.0 111.291 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.1 ptpt -64.42 -34.67 78.73 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.229 -177.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.404 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.2 mp -64.14 -40.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 O-C-N 123.395 0.434 . . . . 0.0 111.187 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.1 mt-30 -65.76 -52.49 50.57 Favored 'General case' 0 CA--C 1.489 -1.375 0 CA-C-O 121.504 0.669 . . . . 0.0 110.471 -177.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -72.18 -27.93 62.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.31 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 37.2 tt0 -61.62 -51.97 66.3 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 123.635 0.584 . . . . 0.0 109.631 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -62.39 -40.31 96.07 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.489 -178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' N ' HD13 ' A' ' 79' ' ' LEU . 3.4 tm-20 -62.62 -49.74 73.98 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 123.366 0.666 . . . . 0.0 110.468 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -75.01 -35.49 61.97 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.786 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.572 177.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.35 -46.48 48.92 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.226 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -59.22 -42.24 90.53 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 120.967 0.413 . . . . 0.0 110.596 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.48 -43.59 89.75 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.851 176.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -55.96 -49.44 73.53 Favored 'General case' 0 C--O 1.264 1.823 0 CA-C-O 121.42 0.628 . . . . 0.0 109.868 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -53.51 -54.61 34.79 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.302 176.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 33.6 m -60.85 -43.16 98.7 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.273 0.983 . . . . 0.0 110.481 -176.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 40.2 t -58.45 -49.55 76.93 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.414 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -77.13 -52.48 9.2 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 117.679 -1.608 . . . . 0.0 112.828 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.493 ' HB3' ' CD2' ' A' ' 17' ' ' HIS . 77.6 p . . . . . 0 C--N 1.318 -0.795 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.449 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.0 ttt . . . . . 0 N--CA 1.442 -0.86 0 CA-C-O 120.898 0.38 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' B' ' 146' ' ' ARG 0.282 21.0 mt-10 -49.57 -28.03 5.16 Favored 'General case' 0 C--O 1.187 -2.229 0 N-CA-C 116.574 2.064 . . . . 0.0 116.574 -176.415 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 p -54.79 -60.04 3.91 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 119.167 0.894 . . . . 0.0 111.274 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 pt -68.99 -25.47 30.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.753 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.573 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 17.4 mm -70.87 -40.52 76.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.196 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.747 177.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 24.5 mmm180 -60.83 -47.8 84.7 Favored 'General case' 0 CA--C 1.498 -1.019 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.4 p -60.11 -38.25 82.42 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 119.564 -0.854 . . . . 0.0 111.747 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.6 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 55.2 mm-40 -66.17 -57.56 7.36 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 175.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.41 HD21 ' OD1' ' A' ' 42' ' ' ASN . 4.3 pp -61.48 -23.75 66.1 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -173.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 70.0 mtm . . . . . 0 C--O 1.239 0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.796 177.775 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.513 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 CA--C 1.524 0.647 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.489 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 65.8 p-90 -71.31 -5.68 34.16 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.558 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 25.4 p80 -70.51 -11.89 61.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.91 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 13.1 pt-20 -90.71 -6.83 53.96 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.989 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.489 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 17.7 m-70 -95.08 5.88 50.62 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.408 0.683 . . . . 0.0 110.044 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.545 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.4 p -133.07 121.46 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 m -77.91 149.88 34.15 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -36.1 79.79 Favored 'General case' 0 C--O 1.205 -1.242 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -66.02 -29.26 69.6 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 177.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.516 ' O ' HD23 ' A' ' 18' ' ' LEU . 3.2 tm? -73.22 -51.55 17.29 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -177.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.508 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.3 ptm180 -65.14 -43.07 93.05 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.106 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.402 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 38.9 t -64.68 -28.83 69.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 121.464 0.649 . . . . 0.0 109.288 178.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -67.23 -43.86 80.93 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.637 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.516 HD23 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -63.46 -37.45 87.33 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.313 176.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 15' ' ' ARG . 89.7 t -55.03 -47.05 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.423 0.689 . . . . 0.0 109.595 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.438 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 13.2 t-80 -63.31 -37.05 85.75 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.313 178.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.66 -32.65 66.0 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 118.891 -1.124 . . . . 0.0 111.783 176.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt -57.06 -43.68 82.27 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 23.4 t -57.63 -46.79 86.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.1 172.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -69.96 -31.16 68.73 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -73.36 -45.9 52.31 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.441 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.564 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.3 tt -70.85 -33.74 53.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.393 0.616 . . . . 0.0 110.781 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -127.02 81.74 69.35 Favored Pre-proline 0 N--CA 1.418 -2.074 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.717 -174.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.57 120.15 7.36 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.346 2.697 . . . . 0.0 109.358 169.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.5 112.72 4.54 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 -170.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.38 -12.42 9.12 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 121.82 1.68 . . . . 0.0 108.498 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -176.83 137.56 0.43 Allowed Pre-proline 0 CA--C 1.496 -1.126 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.93 -22.19 73.66 Favored 'Trans proline' 0 N--CA 1.45 -1.061 0 C-N-CA 121.989 1.793 . . . . 0.0 112.158 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.88 -3.47 57.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.914 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.07 -10.72 59.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.107 0.956 . . . . 0.0 108.453 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.84 5.4 25.28 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.627 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.6 16.92 3.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.638 0.733 . . . . 0.0 110.351 175.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.57 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.0 t70 -83.19 179.1 7.82 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.806 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.555 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -69.86 -26.76 64.36 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 12.1 ttm180 -68.03 -21.01 65.04 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.57 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 9.0 tpp -63.44 -44.01 95.77 Favored 'General case' 0 C--O 1.206 -1.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.315 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.1 pt-20 -62.62 -30.02 71.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 119.347 -0.941 . . . . 0.0 109.73 -177.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.426 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.9 t30 -71.41 -47.65 54.69 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 124.57 1.148 . . . . 0.0 110.309 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 82.5 mt -69.11 -41.8 76.93 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.391 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.499 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -73.32 -27.82 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.404 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -63.09 -48.78 77.12 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.537 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 3.1 t80 -56.23 -42.41 77.25 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.108 0.563 . . . . 0.0 109.889 173.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.84 -42.52 85.61 Favored 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.083 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -64.44 -42.48 95.97 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.508 0.323 . . . . 0.0 111.638 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 5.1 ptmt -63.02 -44.81 94.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.244 176.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 52.7 t -63.66 -50.04 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.602 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -56.28 -46.7 79.61 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 109.201 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . -59.53 -44.06 97.07 Favored Glycine 0 N--CA 1.443 -0.847 0 O-C-N 123.945 0.778 . . . . 0.0 112.335 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.69 -54.36 47.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 122.787 0.435 . . . . 0.0 110.838 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.0 OUTLIER -68.22 -31.97 71.85 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.558 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 83.9 t80 -61.74 -46.35 90.01 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 123.703 0.801 . . . . 0.0 109.848 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 52' ' ' GLY . 35.5 mt-10 -80.1 -22.75 41.84 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.016 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 46.4 m -76.35 -30.61 57.69 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.86 167.27 15.31 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -115.04 7.43 15.5 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.47 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.421 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 70.0 m -159.97 153.66 22.71 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.545 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -71.16 -36.63 72.08 Favored 'General case' 0 C--O 1.179 -2.617 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -177.943 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.421 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 5.2 p-10 -70.07 -27.29 64.5 Favored 'General case' 0 C--N 1.29 -1.982 0 C-N-CA 124.17 0.988 . . . . 0.0 108.792 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.46 -46.75 46.42 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.19 99.28 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.493 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 1.2 t80 -55.0 -49.5 71.36 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.317 1.447 . . . . 0.0 109.591 174.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -64.49 -53.97 39.72 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.169 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.6 pp -69.03 -30.02 68.3 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.94 -176.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.0 OUTLIER -70.4 -39.53 74.42 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.444 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -63.02 -34.43 77.56 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 123.567 0.542 . . . . 0.0 110.096 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -71.08 -38.71 72.42 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.636 176.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -76.24 -35.46 58.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 118.976 -1.09 . . . . 0.0 111.236 -179.269 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.592 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.3 tt -67.75 -36.91 77.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.553 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.5 t80 -53.23 -53.01 56.95 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.133 1.373 . . . . 0.0 111.263 174.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.3 ptpt -67.84 -31.97 72.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.784 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.48 -43.38 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 O-C-N 123.402 0.439 . . . . 0.0 110.09 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.2 mt-30 -62.9 -54.28 41.04 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.093 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.4 ptpt -68.54 -27.87 66.48 Favored 'General case' 0 N--CA 1.398 -3.063 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.431 -176.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -62.88 -52.57 62.58 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 177.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -64.31 -38.06 89.69 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.66 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.88 -41.37 87.34 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 123.489 0.493 . . . . 0.0 111.686 178.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.2 pt-20 -72.7 -42.65 63.97 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -178.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HE2' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.426 -1.636 0 CA-C-O 120.641 0.257 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 3.2 mm? -63.56 -52.45 61.03 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.209 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -68.79 -44.32 73.86 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.229 -178.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.56 -41.11 98.43 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.353 0.408 . . . . 0.0 110.977 -178.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.49 -45.87 87.81 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 49.1 mt -57.73 -58.55 7.84 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.102 177.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.7 m -55.32 -38.95 69.37 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.307 0.575 . . . . 0.0 111.167 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.2 p -77.63 -43.8 30.32 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.566 -175.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -74.64 -37.62 62.73 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.624 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 68.3 p . . . . . 0 N--CA 1.471 0.615 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -177.991 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.677 ' SD ' HD12 ' B' ' 144' ' ' ILE . 14.0 tpt . . . . . 0 C--O 1.215 -0.753 0 CA-C-O 121.285 0.564 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.432 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 24.6 tt0 -53.97 -27.15 29.55 Favored 'General case' 0 CA--C 1.567 1.627 0 C-N-CA 124.793 1.237 . . . . 0.0 112.298 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -63.27 -59.41 4.76 Favored 'General case' 0 C--O 1.276 2.46 0 CA-C-O 121.282 0.563 . . . . 0.0 110.756 178.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.677 HD12 ' SD ' ' B' ' 141' ' ' MET . 46.7 pt -62.95 -28.53 45.23 Favored 'Isoleucine or valine' 0 C--N 1.354 0.773 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.564 ' CG2' HD11 ' A' ' 26' ' ' ILE . 10.6 mm -65.27 -43.69 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.839 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.1 177.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.455 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 74.9 mtt85 -63.55 -40.94 98.3 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 119.97 -0.692 . . . . 0.0 111.689 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.8 p -66.6 -26.21 66.98 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.383 176.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -80.59 -49.82 10.8 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.864 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.455 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.7 pp -67.39 -29.22 68.68 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.67 -0.644 . . . . 0.0 111.446 -176.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 39.2 tpp . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.17 -178.49 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.915 0 N-CA-C 114.134 0.413 . . . . 0.0 114.134 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -64.17 -10.06 20.71 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -60.24 -27.71 67.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.992 0.425 . . . . 0.0 111.24 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.59 -5.45 59.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.105 0.478 . . . . 0.0 111.062 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -96.52 -24.75 15.92 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.554 0.692 . . . . 0.0 110.153 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -96.71 124.36 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.661 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.749 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 m -86.08 151.62 23.54 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.061 -176.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -42.21 78.0 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 122.996 0.519 . . . . 0.0 110.291 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -61.45 -31.74 71.7 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.596 ' O ' HD21 ' A' ' 18' ' ' LEU . 3.4 tm? -72.64 -52.32 15.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 -174.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.5 ptm180 -62.58 -45.99 90.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.96 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 m -67.13 -23.48 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.033 0.444 . . . . 0.0 110.561 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.471 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 25.4 t60 -68.59 -45.18 72.71 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.596 HD21 ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -62.19 -38.69 90.07 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.674 177.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 15' ' ' ARG . 94.2 t -54.72 -47.77 73.27 Favored 'Isoleucine or valine' 0 C--O 1.256 1.4 0 C-N-CA 123.138 0.575 . . . . 0.0 110.235 176.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -58.64 -44.75 90.16 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.132 178.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -29.75 65.64 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' A' ' 19' ' ' VAL . 74.1 mt -56.99 -45.17 83.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 175.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.412 HG11 ' HE2' ' A' ' 40' ' ' MET . 15.3 t -61.95 -51.44 72.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 O-C-N 123.799 0.687 . . . . 0.0 111.436 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -63.97 -25.81 68.3 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.341 -175.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.447 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.34 -45.52 16.04 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.587 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.489 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.2 tt -70.57 -31.0 44.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.523 0.677 . . . . 0.0 109.391 -177.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -127.93 90.43 47.73 Favored Pre-proline 0 N--CA 1.407 -2.616 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.086 -176.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.09 104.31 0.58 Allowed 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 121.848 1.698 . . . . 0.0 108.156 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.43 117.65 17.85 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 118.203 2.668 . . . . 0.0 118.203 -168.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -80.05 -19.52 9.39 Favored 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 122.468 2.112 . . . . 0.0 110.251 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -156.94 144.65 14.02 Favored Pre-proline 0 CA--C 1.483 -1.601 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.95 -12.47 26.1 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.145 1.23 . . . . 0.0 110.167 174.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.04 -13.75 60.9 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.069 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -21.66 63.38 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.67 0.748 . . . . 0.0 109.601 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.41 2.11 54.92 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.346 -178.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -136.09 19.01 3.21 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.529 0.681 . . . . 0.0 110.222 173.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.531 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 18.1 t70 -88.61 -179.37 6.02 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.531 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.88 -28.25 64.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 174.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.6 -23.14 66.76 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.483 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.66 -40.61 97.6 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 179.097 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -65.56 -36.97 85.34 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.526 -178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.48 -43.67 93.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.504 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.51 -43.35 63.7 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.168 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 p -73.47 -34.35 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.812 -179.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.13 95.15 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 175.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.505 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -61.54 -48.63 80.14 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.787 173.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.29 96.78 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 96.8 mttt -67.07 -45.04 78.54 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.259 0.624 . . . . 0.0 111.764 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.0 pttp -64.69 -40.24 95.06 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 54' ' ' MET . 20.7 t -64.91 -51.43 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.229 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.267 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -54.33 -51.31 65.12 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.932 0.893 . . . . 0.0 109.967 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -36.56 93.59 Favored Glycine 0 CA--C 1.52 0.385 0 CA-C-N 116.295 -0.411 . . . . 0.0 113.131 -179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.86 -54.32 48.39 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.793 0.806 . . . . 0.0 108.829 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.556 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.4 ptp -74.31 -28.43 61.16 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.519 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.433 ' HA ' ' CD1' ' A' ' 64' ' ' TYR . 72.5 t80 -59.23 -52.43 65.71 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 174.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -71.82 -27.86 63.2 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.123 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -71.72 -22.63 61.6 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 122.599 0.36 . . . . 0.0 111.638 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.02 168.31 10.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.446 0.641 . . . . 0.0 112.3 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -121.13 13.85 11.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.469 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -156.71 151.48 25.85 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.539 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.8 -36.5 67.59 Favored 'General case' 0 C--O 1.179 -2.614 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.554 177.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.25 -30.52 70.98 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 12.9 tp10 -71.75 -48.08 49.3 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.625 176.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.433 ' CD1' ' HA ' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -61.9 -39.4 91.87 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.602 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.499 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.5 OUTLIER -58.79 -48.23 82.01 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 124.604 1.161 . . . . 0.0 109.131 173.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -64.49 -55.62 19.52 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 122.921 0.488 . . . . 0.0 110.375 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -64.84 -30.45 71.45 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.496 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -76.1 -38.52 56.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.041 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.08 -36.25 82.96 Favored 'General case' 0 C--O 1.19 -2.069 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.71 -44.22 90.95 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.122 0.969 . . . . 0.0 112.407 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.448 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.87 -35.31 67.15 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.973 -178.581 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.613 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.5 tt -72.02 -35.67 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.575 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.16 -52.52 60.87 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 125.799 1.64 . . . . 0.0 110.818 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -67.29 -35.1 78.79 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.544 0.528 . . . . 0.0 110.584 -177.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.75 -42.18 95.07 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.6 mt-30 -63.59 -49.6 72.71 Favored 'General case' 0 CA--C 1.492 -1.278 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.1 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.615 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.4 ptpt -73.46 -29.4 62.51 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.939 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.2 tp10 -58.98 -52.45 65.7 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.69 -39.06 84.44 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.942 -178.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.39 -52.98 59.36 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.246 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.0 pt-20 -69.74 -34.15 73.45 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.347 0.481 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.088 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.445 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 2.9 mm? -69.61 -52.22 27.99 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.505 -175.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -66.16 -43.98 85.41 Favored 'General case' 0 CA--C 1.503 -0.846 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.199 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.99 -43.96 97.74 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 123.68 0.612 . . . . 0.0 110.814 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.36 -45.02 92.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.119 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 66.5 mt -57.03 -62.95 1.39 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.499 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 12.2 t -60.49 -32.77 71.75 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 120.909 0.385 . . . . 0.0 111.722 -174.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 36.9 m -71.74 -49.14 41.83 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.322 0.582 . . . . 0.0 110.329 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.06 -30.22 58.29 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.536 -175.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.471 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 22.8 t . . . . . 0 C--N 1.318 -0.774 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.469 ' SD ' HD12 ' B' ' 144' ' ' ILE . 11.1 tpt . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.504 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 48.4 mt-10 -53.22 -27.24 20.94 Favored 'General case' 0 C--O 1.202 -1.411 0 C-N-CA 124.823 1.249 . . . . 0.0 113.716 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.9 m -65.07 -57.33 8.9 Favored 'General case' 0 C--O 1.263 1.795 0 CA-C-O 121.274 0.559 . . . . 0.0 110.184 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.469 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.9 pp -72.55 -25.49 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.711 0.767 . . . . 0.0 110.563 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.504 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.6 mm -71.14 -33.5 51.37 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.807 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.459 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.4 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 21.8 tpt180 -62.53 -44.72 95.66 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -58.61 -50.74 72.72 Favored 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.123 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.01 -47.05 87.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.773 1.229 . . . . 0.0 112.956 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.468 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.2 pp -71.0 -30.89 67.25 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.85 -0.531 . . . . 0.0 111.546 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.502 -178.221 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.62 0 N-CA-C 115.309 0.884 . . . . 0.0 115.309 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.95 -5.04 27.9 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -63.29 -17.27 62.34 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.25 0.547 . . . . 0.0 111.048 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.29 -22.2 61.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.04 0.448 . . . . 0.0 110.393 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -96.45 3.06 53.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.426 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -134.07 117.23 24.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.692 0.758 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.433 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -97.35 168.38 10.44 Favored 'General case' 0 N--CA 1.402 -2.828 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.75 -45.82 81.8 Favored 'General case' 0 C--O 1.198 -1.641 0 O-C-N 124.659 1.225 . . . . 0.0 109.667 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 5.5 p-10 -55.49 -37.46 67.85 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.4 -48.54 33.11 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.7 ptm180 -69.2 -41.68 76.81 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.447 -177.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -71.78 -23.63 61.61 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.582 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 16.7 t60 -72.34 -39.76 67.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD21 HD22 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -67.3 -35.58 79.75 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.847 175.426 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 15' ' ' ARG . 98.7 t -58.92 -40.33 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 172.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -62.55 -44.13 97.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.859 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.533 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.6 mptp? -68.89 -35.93 77.47 Favored 'General case' 0 CA--C 1.503 -0.837 0 C-N-CA 120.204 -0.598 . . . . 0.0 112.321 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 mt -54.84 -43.37 72.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.2 t -62.29 -50.44 79.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.55 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -66.01 -22.34 66.45 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.903 -176.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.419 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -81.84 -46.23 14.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 177.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.528 HD13 ' CG2' ' B' ' 145' ' ' ILE . 3.6 tt -70.88 -29.33 36.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.604 0 CA-C-O 122.294 1.045 . . . . 0.0 108.891 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -129.05 89.31 48.95 Favored Pre-proline 0 N--CA 1.391 -3.385 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.858 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.89 129.51 33.3 Favored 'Trans proline' 0 N--CA 1.444 -1.395 0 C-N-CA 121.954 1.769 . . . . 0.0 108.446 170.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.406 ' CG2' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -86.23 117.54 68.86 Favored Pre-proline 0 N--CA 1.408 -2.547 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -169.079 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -78.43 -23.93 8.18 Favored 'Trans proline' 0 N--CA 1.443 -1.479 0 N-CA-C 108.995 -1.194 . . . . 0.0 108.995 172.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -170.25 145.13 2.23 Favored Pre-proline 0 N--CA 1.44 -0.936 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.423 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.51 -20.39 40.94 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.832 2.355 . . . . 0.0 113.596 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.67 -11.52 59.88 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.064 -1.022 . . . . 0.0 112.555 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.17 -6.43 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.74 0.781 . . . . 0.0 109.129 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.445 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.2 mt -89.92 7.2 38.52 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.716 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -129.88 15.41 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.93 0.871 . . . . 0.0 109.187 175.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.623 ' O ' ' HB3' ' A' ' 40' ' ' MET . 27.7 t70 -81.75 176.38 9.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.748 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.82 -27.47 63.9 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.034 0.445 . . . . 0.0 110.718 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.599 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.1 ttp180 -72.98 -17.1 61.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.623 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 4.4 tpp -63.08 -45.48 91.93 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.138 176.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.06 -31.16 72.24 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.711 -175.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.452 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -67.56 -49.18 64.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.375 1.47 . . . . 0.0 110.021 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 76.9 mt -67.78 -44.62 76.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.458 -177.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.489 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.4 p -71.81 -30.32 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.346 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.167 -177.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.18 -48.69 80.66 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.2 t80 -59.06 -46.64 87.74 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.468 174.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.16 95.23 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.583 0.23 . . . . 0.0 110.915 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -63.68 -46.28 86.25 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.367 0.667 . . . . 0.0 112.277 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.4 pttp -61.82 -41.35 97.67 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.41 -51.68 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.331 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -57.62 -48.61 78.96 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.848 0.859 . . . . 0.0 109.723 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.93 -40.25 95.1 Favored Glycine 0 N--CA 1.451 -0.356 0 O-C-N 123.762 0.664 . . . . 0.0 112.619 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.57 -54.87 40.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.351 0.26 . . . . 0.0 111.146 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.488 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.3 OUTLIER -68.68 -29.68 68.19 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -62.42 -48.49 79.45 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -79.43 -16.63 55.83 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.488 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 38.8 m -84.43 -23.32 30.04 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.23 165.74 12.96 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -107.99 2.73 23.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.584 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 80.5 p -162.75 159.61 24.39 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.33 -35.36 68.58 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.973 -176.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.58 -35.31 78.76 Favored 'General case' 0 C--O 1.209 -1.06 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -65.03 -47.05 78.78 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.717 174.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -43.37 98.48 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -48.74 79.07 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 124.728 1.211 . . . . 0.0 109.512 175.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -64.05 -49.91 70.49 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.291 0.369 . . . . 0.0 111.575 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.13 -30.39 67.56 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.932 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.431 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.43 -42.21 68.53 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.426 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -60.31 -35.0 74.58 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 123.363 0.665 . . . . 0.0 110.338 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.478 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 5.0 mm-40 -66.82 -48.38 69.13 Favored 'General case' 0 C--O 1.26 1.632 0 C-N-CA 123.444 0.698 . . . . 0.0 112.243 175.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.88 -37.61 70.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.904 -0.718 . . . . 0.0 110.914 -178.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.652 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -66.23 -37.75 80.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.538 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 6.8 t80 -52.59 -54.05 38.28 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 125.232 1.413 . . . . 0.0 111.193 174.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -65.46 -32.41 74.0 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.097 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.467 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.6 mp -65.41 -43.59 94.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 CA-C-O 120.624 0.25 . . . . 0.0 110.508 177.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 63.7 mt-30 -63.29 -53.83 46.74 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.102 -175.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -70.07 -28.78 65.71 Favored 'General case' 0 N--CA 1.395 -3.214 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.023 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.7 tp10 -59.77 -51.7 68.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.655 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -63.31 -44.42 95.0 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.979 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.424 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.5 pt-20 -72.05 -40.24 68.51 Favored 'General case' 0 C--O 1.195 -1.808 0 C-N-CA 119.024 -1.071 . . . . 0.0 113.158 -177.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.2 pt-20 -72.8 -32.97 65.94 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 119.497 1.044 . . . . 0.0 111.681 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.493 -1.245 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.401 177.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.435 -1.21 0 CA-C-O 121.154 0.502 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.91 -45.22 75.0 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-O 121.13 0.49 . . . . 0.0 111.168 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -28.67 62.67 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.513 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.31 -48.37 82.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 109.251 175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -57.1 -50.0 74.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.423 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.64 -54.19 48.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.083 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.4 t -65.09 -28.18 69.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.668 0.27 . . . . 0.0 110.913 -176.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.5 m -73.42 -41.59 63.09 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.075 0.464 . . . . 0.0 110.389 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.409 ' HB3' ' NE2' ' A' ' 17' ' ' HIS . 23.3 m-20 -75.97 -58.74 3.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.979 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.582 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 15.8 t . . . . . 0 C--N 1.312 -1.05 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.655 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 11.9 tpt . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.517 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -47.77 -26.47 1.61 Allowed 'General case' 0 C--O 1.193 -1.9 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.7 m -59.41 -60.6 3.6 Favored 'General case' 0 C--O 1.272 2.251 0 CA-C-N 118.756 0.707 . . . . 0.0 111.503 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.586 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.4 pp -73.63 -25.9 21.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 122.246 1.022 . . . . 0.0 110.711 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.528 ' CG2' HD13 ' A' ' 26' ' ' ILE . 7.3 mm -68.72 -33.71 61.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -66.6 -42.77 86.36 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 m -59.78 -26.96 66.14 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.421 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.545 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 22.8 mm-40 -80.64 -62.71 1.59 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.98 -35.2 74.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -169.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.4 tpt . . . . . 0 C--O 1.241 0.65 0 C-N-CA 120.439 -0.504 . . . . 0.0 111.313 -175.113 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.443 0 N-CA-C 115.87 1.108 . . . . 0.0 115.87 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -72.75 -6.08 42.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -62.11 -18.25 60.21 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.28 0.562 . . . . 0.0 111.534 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -90.15 0.2 57.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.468 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.5 m-70 -113.05 4.39 16.65 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.541 0.686 . . . . 0.0 110.454 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.434 HG22 HD13 ' A' ' 14' ' ' LEU . 7.7 p -129.15 125.68 62.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.1 m -96.54 154.05 17.5 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.093 -175.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -40.62 66.4 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 123.185 0.594 . . . . 0.0 111.105 177.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.42 -33.89 74.46 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.517 ' O ' HD23 ' A' ' 18' ' ' LEU . 2.8 tm? -74.4 -51.05 16.13 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -175.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' HG21 ' A' ' 19' ' ' VAL . 8.1 ptm180 -63.21 -43.05 99.23 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.785 -1.098 . . . . 0.0 112.041 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 35.6 t -67.8 -26.15 65.93 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.65 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.671 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 20.6 t60 -71.95 -38.21 69.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.075 177.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -64.45 -35.57 81.36 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.251 175.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 15' ' ' ARG . 98.1 t -56.06 -49.52 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-O 121.529 0.68 . . . . 0.0 109.654 175.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -57.37 -45.15 84.73 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.798 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HD3' ' CD2' ' B' ' 115' ' ' LEU . 20.2 mttp -67.51 -35.55 79.33 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.351 177.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 19' ' ' VAL . 82.3 mt -56.74 -43.92 81.2 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.629 0.372 . . . . 0.0 110.037 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.441 ' HA ' HG22 ' A' ' 26' ' ' ILE . 85.5 t -63.6 -48.38 87.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.321 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -63.49 -25.21 68.15 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.455 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.01 -46.27 16.91 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.292 176.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.441 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.5 tt -70.44 -35.78 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 109.997 -177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -121.82 99.28 44.6 Favored Pre-proline 0 N--CA 1.397 -3.078 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.512 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.11 98.08 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.967 1.778 . . . . 0.0 108.603 171.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -71.2 132.9 85.85 Favored Pre-proline 0 N--CA 1.426 -1.673 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.321 -174.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -72.63 -37.15 4.25 Favored 'Trans proline' 0 C--O 1.217 -0.561 0 C-N-CA 122.524 2.149 . . . . 0.0 111.53 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -140.73 153.46 67.87 Favored Pre-proline 0 CA--C 1.494 -1.175 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.85 -15.54 49.57 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.338 2.025 . . . . 0.0 111.72 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.47 -18.94 54.14 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.314 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.92 -6.11 53.29 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.603 0.716 . . . . 0.0 110.019 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.8 mt -90.76 -0.48 57.72 Favored 'General case' 0 C--O 1.21 -1.018 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.342 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -132.74 20.6 4.21 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.202 1.001 . . . . 0.0 109.213 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.575 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 16.5 t70 -88.5 170.22 11.08 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.407 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.575 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.6 -25.45 68.1 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 122.997 0.519 . . . . 0.0 112.029 -179.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 -75.14 -19.14 60.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 109.723 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.564 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 7.9 tpp -61.46 -46.56 89.52 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.792 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 12.3 pt-20 -58.85 -29.29 66.84 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 123.263 0.352 . . . . 0.0 110.922 -177.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -71.58 -51.74 21.82 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.68 0.752 . . . . 0.0 110.213 177.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.9 -45.75 84.59 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.103 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.477 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.0 p -73.26 -28.59 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.123 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -58.89 -49.74 76.63 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -56.51 -46.01 80.75 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.893 174.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.88 99.8 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 120.552 0.215 . . . . 0.0 111.187 -178.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.9 mttm -64.48 -48.1 76.47 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.134 0.574 . . . . 0.0 111.313 178.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.619 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.1 pttp -63.58 -40.63 97.44 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-O 121.282 0.563 . . . . 0.0 109.6 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.1 t -64.93 -47.86 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.619 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.9 tm-20 -54.16 -49.1 70.03 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 123.744 0.818 . . . . 0.0 109.766 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.22 -43.06 98.84 Favored Glycine 0 C--O 1.236 0.247 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.491 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.54 -52.42 65.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.97 0.508 . . . . 0.0 110.344 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.476 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 1.2 ptp -71.65 -27.92 63.4 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.572 0.952 . . . . 0.0 113.572 179.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -63.1 -49.48 74.29 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -78.38 -17.4 56.51 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.369 0.604 . . . . 0.0 111.864 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 24.7 m -79.97 -19.4 47.99 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.46 166.34 11.57 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -109.87 4.31 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.909 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -161.55 160.79 29.43 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.15 74.49 Favored 'General case' 0 C--O 1.191 -2.017 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.584 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.75 -31.59 70.74 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.55 -42.56 64.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.359 -0.213 . . . . 0.0 111.016 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -43.21 96.17 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.4 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -56.27 -48.95 75.55 Favored 'General case' 0 C--O 1.197 -1.668 0 C-N-CA 124.924 1.29 . . . . 0.0 108.857 173.74 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -59.37 -55.55 33.25 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 123.492 0.717 . . . . 0.0 111.09 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.405 HD12 ' CB ' ' A' ' 54' ' ' MET . 3.8 pp -71.17 -29.89 65.76 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.314 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.452 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.66 -39.43 70.31 Favored 'General case' 0 C--N 1.344 0.329 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 176.799 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.486 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.28 -35.84 81.69 Favored 'General case' 0 C--O 1.202 -1.415 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.655 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.4 mm-40 -67.42 -42.87 82.51 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.075 0.55 . . . . 0.0 111.668 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -71.1 -36.55 72.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.654 -179.089 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.654 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -70.49 -38.78 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 19.2 t80 -52.81 -54.3 36.15 Favored 'General case' 0 C--O 1.265 1.883 0 C-N-CA 124.972 1.309 . . . . 0.0 110.997 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -65.26 -38.4 90.19 Favored 'General case' 0 C--O 1.189 -2.081 0 O-C-N 123.823 0.702 . . . . 0.0 110.117 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.15 -40.79 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.465 0.478 . . . . 0.0 110.712 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 60.5 mt-30 -61.98 -54.95 34.59 Favored 'General case' 0 CA--C 1.496 -1.115 0 O-C-N 123.87 0.731 . . . . 0.0 110.596 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -73.21 -27.12 61.44 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.815 -177.111 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.3 tt0 -67.9 -43.57 78.98 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -69.57 -33.66 73.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.291 178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 41.5 mt-10 -63.89 -52.91 57.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.184 176.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.84 -38.8 92.43 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.671 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.505 -0.779 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.239 178.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.7 t . . . . . 0 CA--C 1.546 0.815 0 CA-C-O 120.814 0.34 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 4.2 mm? -64.35 -50.59 67.14 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.955 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -69.94 -33.77 72.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.739 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -62.33 -46.84 86.88 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.789 -0.764 . . . . 0.0 110.424 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 66.4 tp -57.9 -41.8 83.37 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.778 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.531 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 50.6 mt -61.94 -66.14 0.58 Allowed 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.229 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.3 m -52.54 -36.01 54.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.457 0.703 . . . . 0.0 112.24 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 54.5 p -76.72 -55.31 5.61 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.975 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.86 -24.34 52.63 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -174.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.671 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 42.4 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -174.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.635 ' O ' HG12 ' B' ' 145' ' ' ILE . 16.0 tpt . . . . . 0 C--O 1.204 -1.313 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.433 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 7.1 tt0 -71.59 -25.99 62.41 Favored 'General case' 0 C--O 1.193 -1.88 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.678 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.5 m -55.47 -51.83 65.67 Favored 'General case' 0 C--O 1.266 1.971 0 CA-C-O 121.134 0.492 . . . . 0.0 110.329 175.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.561 HD11 ' SD ' ' B' ' 141' ' ' MET . 43.3 pt -67.0 -32.87 59.96 Favored 'Isoleucine or valine' 0 C--N 1.342 0.249 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.635 HG12 ' O ' ' B' ' 141' ' ' MET . 22.4 mm -65.68 -33.47 63.86 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.82 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.198 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.416 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 58.0 ttp180 -65.27 -43.02 92.58 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 49.3 m -62.41 -37.45 85.85 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.767 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.619 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 12.7 mm-40 -72.82 -43.85 62.18 Favored 'General case' 0 C--O 1.199 -1.575 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 178.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.416 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -68.13 -33.92 75.38 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.362 0.528 . . . . 0.0 110.673 -177.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 CA--C 1.496 -1.11 0 CA-C-O 121.046 0.45 . . . . 0.0 109.867 174.972 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.459 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 p-90 -70.48 -12.16 61.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.468 ' CD2' ' HG3' ' A' ' 8' ' ' GLU . 0.3 OUTLIER -64.77 -19.47 65.83 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.049 0.452 . . . . 0.0 111.859 -177.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.468 ' HG3' ' CD2' ' A' ' 7' ' ' HIS . 46.2 mt-10 -90.23 -8.54 50.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.438 0.637 . . . . 0.0 110.117 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -96.89 10.74 38.17 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.89 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.493 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.8 p -138.5 115.01 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.0 m -91.96 154.45 18.81 Favored 'General case' 0 C--N 1.289 -2.039 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.82 -41.62 45.29 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 123.527 0.731 . . . . 0.0 111.047 177.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.52 -41.15 72.73 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.143 0.577 . . . . 0.0 111.535 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.41 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -74.09 -50.47 19.4 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -173.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.465 ' O ' HG22 ' A' ' 19' ' ' VAL . 9.1 ptm180 -65.53 -38.41 89.57 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.026 -177.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -74.01 -22.67 59.5 Favored 'General case' 0 N--CA 1.423 -1.801 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 26.0 t60 -74.15 -35.26 64.05 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 174.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.452 HD23 HD23 ' A' ' 68' ' ' LEU . 3.1 mp -63.9 -38.27 90.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.465 HG22 ' O ' ' A' ' 15' ' ' ARG . 76.3 t -60.89 -46.57 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.465 0.706 . . . . 0.0 109.421 172.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.451 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 23.5 t-80 -53.72 -48.48 69.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.438 176.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -65.21 -39.32 92.64 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.906 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.9 mt -54.65 -48.05 72.79 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.216 0.322 . . . . 0.0 110.417 174.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.25 -48.99 85.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.018 0 O-C-N 123.842 0.714 . . . . 0.0 111.481 174.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -71.3 -20.58 62.18 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -176.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.456 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.36 -46.2 15.02 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.05 176.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.554 HD12 ' CG2' ' B' ' 145' ' ' ILE . 1.7 tt -70.47 -35.15 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-O 122.269 1.033 . . . . 0.0 108.724 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -127.87 89.14 51.42 Favored Pre-proline 0 N--CA 1.398 -3.035 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.946 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.41 84.16 0.37 Allowed 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.954 1.769 . . . . 0.0 107.663 171.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 t -52.14 134.58 40.34 Favored Pre-proline 0 N--CA 1.424 -1.735 0 CA-C-N 113.965 -1.47 . . . . 0.0 113.396 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.49 -22.35 21.42 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.203 2.602 . . . . 0.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -157.38 141.57 11.69 Favored Pre-proline 0 CA--C 1.511 -0.555 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -178.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -56.92 -18.09 26.49 Favored 'Trans proline' 0 CA--C 1.549 1.262 0 C-N-CA 122.921 2.414 . . . . 0.0 114.346 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.77 -15.17 57.98 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 121.493 -0.754 . . . . 0.0 112.06 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.39 -9.6 58.86 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.879 0.847 . . . . 0.0 109.463 176.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.8 mt -89.4 1.56 55.66 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 114.704 -1.134 . . . . 0.0 110.494 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -134.89 12.6 3.65 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.389 1.09 . . . . 0.0 109.497 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.581 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 31.7 t70 -87.36 177.65 7.06 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.985 -1.461 . . . . 0.0 110.001 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.581 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -18.08 62.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.435 0.636 . . . . 0.0 110.668 178.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -74.37 -28.02 60.92 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.473 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -64.48 -43.5 93.96 Favored 'General case' 0 C--O 1.193 -1.913 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.479 -176.394 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.437 ' HA ' HG22 ' A' ' 44' ' ' VAL . 7.1 pt-20 -61.58 -29.6 70.13 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.088 0.47 . . . . 0.0 110.966 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -74.61 -44.2 51.82 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.698 176.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.74 -42.38 81.95 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.711 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.533 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 28.4 m -69.83 -35.77 66.54 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.124 0 CA-C-O 119.08 -0.486 . . . . 0.0 110.125 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.97 85.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.41 0.624 . . . . 0.0 109.691 176.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.501 ' CE1' HD11 ' A' ' 26' ' ' ILE . 4.3 t80 -60.69 -47.42 86.36 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.826 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.4 93.97 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.017 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 67.6 mttm -66.3 -44.33 83.77 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.292 0.637 . . . . 0.0 111.443 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.9 pttp -63.46 -41.11 98.62 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.599 0.714 . . . . 0.0 109.602 -179.048 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.0 t -66.29 -51.98 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.022 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.413 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.4 tm-20 -55.76 -47.79 76.4 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.271 1.029 . . . . 0.0 109.846 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.44 -38.62 96.06 Favored Glycine 0 N--CA 1.443 -0.857 0 O-C-N 123.665 0.603 . . . . 0.0 112.717 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -62.03 -51.95 65.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.452 0.644 . . . . 0.0 110.883 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.545 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.2 ptp -72.15 -27.29 62.5 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.929 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -62.54 -53.74 50.2 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.61 -26.45 65.37 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.863 -179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 t -78.87 -22.92 45.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -86.27 163.34 17.78 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.753 0.787 . . . . 0.0 112.847 -176.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -108.12 4.5 24.99 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.112 -178.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.421 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 9.8 p -167.32 154.9 8.97 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.693 0.797 . . . . 0.0 108.949 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.493 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.17 -31.8 66.26 Favored 'General case' 0 C--O 1.194 -1.866 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.616 -175.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.421 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 6.1 p-10 -72.23 -28.54 63.23 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 8.8 tp10 -73.63 -44.21 57.52 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -41.22 98.64 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-O 120.969 0.414 . . . . 0.0 109.94 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.445 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -55.85 -48.52 75.38 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 124.349 1.059 . . . . 0.0 108.293 171.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.526 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.3 t-80 -61.82 -57.91 10.0 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.732 1.213 . . . . 0.0 111.859 -175.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.545 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -66.41 -30.26 70.59 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.479 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -76.11 -34.22 59.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.438 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.472 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -65.11 -31.41 72.6 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 176.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 24.8 mm-40 -65.76 -50.14 65.82 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.954 0.883 . . . . 0.0 109.392 174.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -62.26 -45.24 94.16 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.101 -179.648 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.614 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -68.79 -34.84 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.677 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -176.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 34.0 t80 -55.63 -54.45 43.97 Favored 'General case' 0 C--O 1.271 2.223 0 C-N-CA 124.515 1.126 . . . . 0.0 110.471 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.3 ptpt -66.83 -32.45 73.73 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.83 -176.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.38 -41.67 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 O-C-N 123.152 0.283 . . . . 0.0 110.5 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.614 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 58.0 mt-30 -62.73 -51.54 66.76 Favored 'General case' 0 CA--C 1.478 -1.805 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.604 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -70.89 -26.81 63.4 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.409 -178.853 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.17 -52.59 64.67 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -64.33 -39.46 93.94 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.968 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.53 -53.25 60.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 123.555 0.534 . . . . 0.0 111.345 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 77' ' ' LYS 0.266 13.1 pt-20 -76.69 -35.51 57.85 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -177.091 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 C-N-CA 118.976 -1.089 . . . . 0.0 111.8 -178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' THR . . . . . 0.584 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 17.6 m . . . . . 0 N--CA 1.442 -0.872 0 CA-C-O 121.304 0.573 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.29 -48.96 60.15 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.39 -178.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -66.08 -32.43 73.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.694 -177.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.78 -47.28 84.19 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.95 0.781 . . . . 0.0 109.379 175.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' B' ' 110' ' ' THR . 94.8 mt -56.33 -41.56 76.27 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.778 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.83 -64.9 0.69 Allowed 'General case' 0 C--N 1.347 0.465 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.157 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.445 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 8.9 t -62.48 -33.42 74.81 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -174.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 27.2 p -70.77 -50.89 31.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -76.05 -46.49 28.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 119.136 -1.026 . . . . 0.0 112.308 -177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 9.7 m . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -172.598 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 10.4 ttm . . . . . 0 C--O 1.257 1.471 0 CA-C-O 121.416 0.627 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.511 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 32.8 mt-10 -48.89 -27.5 3.12 Favored 'General case' 0 C--O 1.191 -1.992 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -178.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 1.6 m -57.62 -59.61 4.93 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 119.415 1.007 . . . . 0.0 109.881 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.06 -24.24 24.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.748 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.554 ' CG2' HD12 ' A' ' 26' ' ' ILE . 9.4 mm -72.0 -45.65 62.82 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.389 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.755 175.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.482 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 96.8 mtt180 -63.69 -35.9 82.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 117.833 0.288 . . . . 0.0 110.902 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.1 m -62.12 -50.66 71.02 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.874 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.73 -40.7 98.03 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.474 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.482 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -75.67 -22.75 56.44 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.64 -0.663 . . . . 0.0 112.492 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 41.3 tpp . . . . . 0 C--N 1.34 0.17 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 173.236 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.914 0 N-CA-C 116.964 1.545 . . . . 0.0 116.964 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 p-90 -62.59 -16.87 58.56 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -12.59 54.24 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.987 0.423 . . . . 0.0 112.072 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.78 -26.01 34.81 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 109.818 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -90.87 2.75 55.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.687 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.6 110.52 11.42 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-O 121.535 0.683 . . . . 0.0 109.501 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.43 171.12 8.9 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.991 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.47 -43.57 68.26 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 124.298 0.999 . . . . 0.0 110.807 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -52.53 -44.23 65.62 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.589 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -75.72 -47.54 25.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -172.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.465 ' O ' HG21 ' A' ' 19' ' ' VAL . 10.0 ptm180 -65.68 -44.72 85.36 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.486 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -68.93 -23.12 64.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 121.261 0.553 . . . . 0.0 109.545 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.659 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 34.3 t60 -68.38 -44.75 74.48 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 174.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.589 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.7 OUTLIER -63.12 -37.66 88.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 119.217 -0.993 . . . . 0.0 109.725 176.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 15' ' ' ARG . 84.6 t -54.27 -46.74 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.586 0.554 . . . . 0.0 109.781 175.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.506 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 53.9 t-80 -61.05 -41.59 96.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.048 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.485 ' HE2' ' OE1' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -73.26 -31.34 64.03 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.167 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 19' ' ' VAL . 88.0 mt -56.9 -42.51 80.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 173.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 24.0 t -59.36 -53.53 46.91 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.848 172.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 46.3 mt-30 -61.76 -26.34 68.02 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.439 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -81.65 -46.99 13.56 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.562 177.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.554 HD13 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -71.86 -29.65 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 122.111 0.957 . . . . 0.0 109.943 -177.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -130.23 83.43 63.02 Favored Pre-proline 0 N--CA 1.4 -2.954 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.306 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.48 84.03 0.13 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.58 2.186 . . . . 0.0 107.959 170.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.415 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 12.0 t -58.35 142.62 81.41 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.401 -171.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.11 -30.93 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.345 2.03 . . . . 0.0 110.57 174.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -146.12 139.77 14.87 Favored Pre-proline 0 CA--C 1.506 -0.75 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 -175.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -54.46 -22.13 26.41 Favored 'Trans proline' 0 CA--C 1.563 1.935 0 C-N-CA 122.668 2.245 . . . . 0.0 114.168 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.68 -10.0 59.72 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 121.199 -0.938 . . . . 0.0 112.105 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.415 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -80.39 -7.94 59.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 109.694 176.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 40' ' ' MET . 35.6 mt -86.93 2.73 48.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.225 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -133.12 16.12 4.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.544 0.688 . . . . 0.0 109.467 178.198 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 40' ' ' MET . 24.3 t70 -81.48 176.98 9.23 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.037 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.512 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.67 -22.78 62.44 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.918 -0.488 . . . . 0.0 111.725 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -73.1 -22.03 60.64 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.61 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.2 tpp -61.3 -45.61 93.74 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.838 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -59.62 -30.72 68.9 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.766 -0.773 . . . . 0.0 111.155 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -72.34 -46.05 57.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.068 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.13 -42.11 76.46 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.478 -178.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.61 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.7 p -73.26 -30.84 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.573 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.68 91.97 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.505 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -59.67 -48.36 81.96 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.272 175.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.32 97.17 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 120.617 0.246 . . . . 0.0 110.964 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -65.11 -45.4 85.28 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.5 pttp -62.47 -40.98 98.41 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.0 t -65.07 -52.78 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.991 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.214 179.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.401 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.1 tm-20 -57.65 -48.28 79.93 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.906 0.883 . . . . 0.0 109.652 -178.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.62 -40.52 94.78 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.963 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.28 -54.28 47.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.401 0.619 . . . . 0.0 110.5 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.482 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.5 ptp -68.75 -30.05 68.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -66.84 -38.41 86.33 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.831 0.824 . . . . 0.0 108.936 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -82.48 -25.62 33.36 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.868 -1.145 . . . . 0.0 112.648 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -82.93 -26.65 31.22 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 120.907 0.384 . . . . 0.0 111.898 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.72 155.76 25.36 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -175.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -102.33 -0.29 32.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.097 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 p -156.9 159.3 38.01 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.11 -27.61 62.75 Favored 'General case' 0 C--O 1.17 -3.12 0 C-N-CA 118.288 -1.365 . . . . 0.0 109.504 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.85 -40.35 87.88 Favored 'General case' 0 C--O 1.209 -1.037 0 O-C-N 123.625 0.578 . . . . 0.0 109.501 178.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.8 -45.52 85.91 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.82 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -47.55 82.61 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.449 ' HD1' ' N ' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -51.2 -48.63 61.94 Favored 'General case' 0 C--O 1.21 -0.988 0 C-N-CA 125.892 1.677 . . . . 0.0 109.756 174.055 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.486 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 28.7 t-80 -74.15 -49.39 23.9 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.676 -169.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.73 -29.46 68.7 Favored 'General case' 0 C--O 1.249 1.065 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.502 -178.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.482 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -73.22 -40.03 65.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.171 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.1 -34.5 75.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 123.381 0.425 . . . . 0.0 109.93 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 7.4 mm-40 -63.68 -46.28 86.28 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.362 0.665 . . . . 0.0 111.005 175.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.32 -36.97 69.02 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.345 -0.942 . . . . 0.0 112.108 -178.163 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.584 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -67.03 -38.75 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.505 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.96 -54.51 37.94 Favored 'General case' 0 C--O 1.254 1.329 0 C-N-CA 124.824 1.25 . . . . 0.0 111.271 175.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 16.9 ptpt -66.04 -33.84 76.72 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.461 -175.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.71 -44.31 96.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 123.439 0.462 . . . . 0.0 111.103 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.2 mt-30 -61.27 -50.75 71.74 Favored 'General case' 0 CA--C 1.49 -1.341 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -176.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.613 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -73.62 -29.17 62.2 Favored 'General case' 0 N--CA 1.395 -3.221 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.961 -177.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 28.4 tt0 -62.61 -52.62 62.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.834 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 3.9 pp -60.61 -45.45 93.96 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 123.818 0.699 . . . . 0.0 110.813 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.55 -53.72 54.83 Favored 'General case' 0 N--CA 1.401 -2.923 0 O-C-N 123.898 0.749 . . . . 0.0 111.29 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.1 pt-20 -71.92 -34.27 68.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 119.769 -0.772 . . . . 0.0 113.043 -176.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.507 ' HB2' ' HZ3' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.65 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.482 179.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 47.4 m . . . . . 0 N--CA 1.44 -0.933 0 CA-C-O 121.017 0.436 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.49 -54.9 21.62 Favored 'General case' 0 C--O 1.247 0.957 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.949 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.07 -25.14 60.8 Favored 'General case' 0 C--O 1.247 0.971 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -60.1 -51.27 70.34 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.88 -45.61 86.11 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.935 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.12 -61.51 2.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.471 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.5 m -60.21 -40.61 90.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.424 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 60.7 p -77.39 -35.12 54.64 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.039 -174.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.1 -49.86 32.87 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.624 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' SER . . . . . 0.659 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 37.9 t . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -177.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.834 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 15.3 ttt . . . . . 0 N--CA 1.443 -0.795 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.533 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.6 mt-10 -48.57 -27.99 3.14 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -178.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.0 p -56.93 -59.7 4.66 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 121.671 0.748 . . . . 0.0 111.485 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.19 -24.3 24.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.406 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.554 ' CG2' HD13 ' A' ' 26' ' ' ILE . 14.8 mm -63.43 -46.45 95.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.79 173.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -59.85 -42.61 94.03 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 123.994 0.809 . . . . 0.0 109.19 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.5 m -66.33 -34.07 77.14 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.762 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -47.33 22.99 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.44 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.1 pp -66.94 -25.25 66.26 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 50.5 tpp . . . . . 0 CA--C 1.514 -0.416 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 175.934 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.358 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.3 m -82.23 160.48 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.228 0 CA-C-O 121.183 0.516 . . . . 0.0 111.449 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -83.88 102.66 12.54 Favored 'General case' 0 N--CA 1.414 -2.256 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.946 -173.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -108.16 118.8 37.7 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -28.68 53.54 Favored Glycine 0 C--N 1.31 -0.887 0 N-CA-C 114.176 0.43 . . . . 0.0 114.176 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -67.18 -19.24 65.54 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -71.32 -10.21 59.38 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 119.765 -0.774 . . . . 0.0 113.017 -175.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -83.69 -7.12 59.55 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.762 0.791 . . . . 0.0 109.185 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -99.81 7.14 45.23 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.001 -177.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.8 p -139.54 114.67 7.96 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.526 0.679 . . . . 0.0 109.348 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.1 166.28 13.5 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -49.13 -41.61 36.69 Favored 'General case' 0 C--O 1.206 -1.224 0 C-N-CA 124.351 1.061 . . . . 0.0 111.154 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -52.06 -47.07 65.3 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.203 0.601 . . . . 0.0 111.925 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -72.05 -45.83 59.32 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.3 ptm180 -70.07 -42.58 72.6 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.752 -177.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.9 t -67.89 -26.74 66.15 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.584 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 8.7 t60 -70.7 -43.35 69.18 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 176.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.469 HD23 HD22 ' A' ' 68' ' ' LEU . 2.4 mp -65.36 -37.91 88.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.478 176.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -57.05 -45.43 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 173.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 12.2 t-80 -57.98 -44.97 87.41 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.58 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.584 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.1 mptp? -64.36 -38.17 90.09 Favored 'General case' 0 CA--C 1.506 -0.713 0 C-N-CA 119.977 -0.689 . . . . 0.0 112.635 177.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 19' ' ' VAL . 81.4 mt -54.75 -44.92 74.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 123.381 0.426 . . . . 0.0 109.88 176.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.437 HG12 ' HE1' ' A' ' 40' ' ' MET . 54.0 t -63.83 -48.4 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.812 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 35.4 mt-30 -60.25 -27.96 67.66 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 120.954 0.407 . . . . 0.0 111.906 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -81.21 -46.58 14.61 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.772 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.503 HD12 ' CG2' ' B' ' 145' ' ' ILE . 3.7 tt -71.35 -30.18 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.699 0.762 . . . . 0.0 110.12 -176.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -127.89 103.87 21.14 Favored Pre-proline 0 N--CA 1.409 -2.494 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.341 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.57 76.5 0.54 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.848 2.365 . . . . 0.0 110.463 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.445 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 13.0 t -60.46 126.42 84.56 Favored Pre-proline 0 N--CA 1.423 -1.807 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.976 -175.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -73.18 -29.91 11.1 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.341 2.027 . . . . 0.0 111.574 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -146.9 143.87 19.12 Favored Pre-proline 0 C--N 1.308 -1.233 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -53.74 -18.28 11.93 Favored 'Trans proline' 0 CA--C 1.557 1.634 0 C-N-CA 122.652 2.235 . . . . 0.0 114.05 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.56 -13.41 59.55 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.566 -0.709 . . . . 0.0 112.469 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.445 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -78.36 -6.53 55.43 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.452 1.12 . . . . 0.0 108.747 175.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.447 ' O ' ' HG2' ' A' ' 40' ' ' MET . 21.8 mt -89.97 7.75 35.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.383 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.448 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -132.72 18.55 4.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.817 0.818 . . . . 0.0 109.323 173.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.575 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 20.5 t70 -80.79 173.78 12.27 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.477 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.575 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -65.5 -24.98 67.27 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 121.955 -0.465 . . . . 0.0 110.901 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 33.1 ttm180 -74.9 -22.35 58.68 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.729 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.0 tpp -59.4 -45.22 92.1 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.732 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -56.3 -36.09 68.27 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.199 0.524 . . . . 0.0 109.866 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.432 ' OD1' HD22 ' B' ' 149' ' ' LEU . 5.8 t30 -76.15 -43.87 40.86 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.377 1.071 . . . . 0.0 111.372 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 78.6 mt -70.04 -40.86 74.87 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.696 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.729 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.32 -30.7 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.896 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -61.21 -49.17 78.21 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 174.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.56 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 6.8 t80 -57.96 -44.44 87.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.674 0.79 . . . . 0.0 110.215 174.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.64 87.87 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.636 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -68.82 -40.3 79.57 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 1.4 ptmt -65.44 -41.74 93.16 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.359 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.7 t -65.5 -52.7 48.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.629 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -57.78 -51.28 70.21 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.648 0.779 . . . . 0.0 110.015 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -39.18 93.33 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 123.495 0.497 . . . . 0.0 112.941 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.96 -51.63 68.46 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.442 0.639 . . . . 0.0 110.91 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.55 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 2.3 ptp -73.59 -27.59 61.38 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.321 -0.854 . . . . 0.0 113.272 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -62.03 -47.39 84.94 Favored 'General case' 0 C--O 1.2 -1.503 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -74.04 -22.62 59.49 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 t -77.54 -32.26 53.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.96 169.46 11.52 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -120.29 17.61 12.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.911 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.7 p -167.88 151.11 5.92 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.55 -33.34 73.91 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.185 -177.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -65.65 -36.96 85.19 Favored 'General case' 0 C--O 1.198 -1.615 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.285 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 9.4 tp10 -67.84 -46.45 71.76 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.63 99.25 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.762 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -48.72 78.9 Favored 'General case' 0 C--O 1.206 -1.22 0 C-N-CA 123.766 0.826 . . . . 0.0 109.054 172.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -61.23 -55.91 26.62 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.6 pp -64.9 -29.65 70.6 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.55 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.3 OUTLIER -76.04 -39.19 56.09 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.8 -29.12 69.94 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 123.02 0.528 . . . . 0.0 109.642 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 72.7 mm-40 -67.81 -53.04 30.11 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.291 0.637 . . . . 0.0 111.656 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.416 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -66.16 -35.65 81.03 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 119.338 -0.945 . . . . 0.0 111.46 -177.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.546 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.99 -40.24 80.69 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 26.8 t80 -52.29 -54.56 29.85 Favored 'General case' 0 C--O 1.257 1.489 0 C-N-CA 125.047 1.339 . . . . 0.0 111.416 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -67.86 -35.46 78.59 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.017 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -62.39 -39.69 85.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 O-C-N 123.424 0.453 . . . . 0.0 110.83 177.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.546 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 46.6 mt-30 -64.36 -55.62 19.88 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 123.518 0.511 . . . . 0.0 110.822 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.548 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.3 ptpt -68.0 -28.66 67.61 Favored 'General case' 0 N--CA 1.417 -2.084 0 C-N-CA 119.632 -0.827 . . . . 0.0 112.459 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 82' ' ' LYS . 13.5 tp10 -58.57 -53.16 61.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 123.639 0.587 . . . . 0.0 109.833 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -67.34 -38.94 85.65 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 123.199 0.312 . . . . 0.0 111.708 -177.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -62.73 -53.16 58.6 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.541 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.7 pt-20 -72.06 -34.32 68.65 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 120.174 -0.61 . . . . 0.0 112.307 -176.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.542 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -64.17 -49.59 71.46 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 119.594 -0.843 . . . . 0.0 111.609 -178.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' B' ' 137' ' ' LEU . 0.6 OUTLIER -76.71 -28.65 55.93 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.124 -174.588 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -85.29 -57.53 3.04 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.7 p -123.61 -14.05 7.38 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 118.471 2.767 . . . . 0.0 118.471 -166.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.542 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 4.1 ptp180 -86.73 -26.75 24.06 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 117.591 -1.644 . . . . 0.0 110.605 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.9 mt . . . . . 0 C--O 1.251 1.161 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.664 177.311 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.715 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' SER . . . . . 0.423 ' H ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 m -124.85 -67.73 0.89 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . 0.328 25.6 ptt? 42.35 73.22 0.14 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.4 m -78.84 -34.25 45.31 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 105.08 -2.193 . . . . 0.0 105.08 171.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -103.98 117.42 34.27 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -78.29 -1.16 31.74 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . 0.522 ' HA2' HE22 ' B' ' 109' ' ' GLN . . . -88.81 65.53 3.26 Favored Glycine 0 N--CA 1.424 -2.117 0 C-N-CA 120.569 -0.824 . . . . 0.0 111.363 175.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 35.3 p-10 -115.67 -1.24 12.75 Favored 'General case' 0 C--N 1.296 -1.731 0 CA-C-N 115.164 -0.518 . . . . 0.0 110.764 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.522 HE22 ' HA2' ' B' ' 107' ' ' GLY . 0.0 OUTLIER -60.26 -34.97 74.48 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.066 -176.605 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 27.2 m -56.85 -50.03 73.67 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 122.884 0.474 . . . . 0.0 110.815 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -72.95 -39.97 65.77 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.314 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 14.8 mm100 -63.49 -43.22 97.88 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.066 0.46 . . . . 0.0 111.076 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -66.89 -36.74 82.98 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 122.721 0.408 . . . . 0.0 110.77 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 61.6 tp -56.57 -53.85 52.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.43 -45.73 90.72 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.954 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.6 m -57.02 -36.14 70.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.985 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 38.5 m -77.27 -58.42 3.28 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.231 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.32 -60.12 4.36 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.601 ' O ' ' HA ' ' B' ' 123' ' ' SER . 6.0 m -74.0 -51.37 16.12 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.664 -171.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.91 -60.32 2.2 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -62.22 -56.41 18.91 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -79.57 -23.98 42.4 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.242 -0.286 . . . . 0.0 111.676 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.601 ' HA ' ' O ' ' B' ' 119' ' ' SER . 19.6 m 71.67 -59.15 0.56 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.792 1.237 . . . . 0.0 113.914 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -116.29 132.79 56.57 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.005 0.431 . . . . 0.0 111.008 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -175.89 65.59 0.1 OUTLIER Glycine 0 N--CA 1.421 -2.355 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -98.71 29.32 11.84 Favored Glycine 0 N--CA 1.443 -0.863 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -152.18 86.78 0.14 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 177.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 28.2 t -142.4 145.59 33.98 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -154.66 160.09 29.38 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 178.78 43.32 0.07 OUTLIER Glycine 0 N--CA 1.44 -1.092 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.746 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -96.54 85.48 0.86 Allowed Glycine 0 C--N 1.301 -1.403 0 N-CA-C 110.359 -1.097 . . . . 0.0 110.359 178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.8 p -68.75 115.56 8.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 121.327 0.585 . . . . 0.0 110.791 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 106.68 -9.76 41.12 Favored Glycine 0 N--CA 1.432 -1.595 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.117 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 119.87 178.86 16.44 Favored Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.064 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -142.62 75.46 0.32 Allowed Glycine 0 N--CA 1.431 -1.648 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.4 m -155.79 32.81 0.35 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.4 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.8 pp -94.15 -16.04 24.1 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.584 -173.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.522 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 3.2 mp0 -45.98 -56.87 4.94 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.038 1.335 . . . . 0.0 109.423 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 63.4 m 48.35 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.913 1.685 . . . . 0.0 114.608 175.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.31 -33.21 67.21 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.597 ' O ' HG12 ' B' ' 145' ' ' ILE . 14.3 tpt -58.77 -37.14 75.63 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.201 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 38.5 mt-10 -58.85 -27.28 64.99 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 24.8 t -61.57 -54.29 45.05 Favored 'General case' 0 C--O 1.249 1.066 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.587 HD12 ' SD ' ' B' ' 141' ' ' MET . 49.3 pt -66.01 -29.26 46.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.597 HG12 ' O ' ' B' ' 141' ' ' MET . 14.2 mm -64.16 -43.39 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.813 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 20.7 mtm180 -59.1 -42.51 90.65 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 48.3 m -59.94 -41.65 92.28 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.517 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 144' ' ' ILE . 28.9 mt-10 -77.2 -38.42 51.52 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.888 -0.508 . . . . 0.0 112.358 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.432 HD22 ' OD1' ' A' ' 42' ' ' ASN . 4.4 pp -75.36 -24.87 57.33 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 58.5 ttp -53.7 -58.5 6.99 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -101.55 155.76 17.89 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.756 0 O-C-N 123.416 0.447 . . . . 0.0 109.999 -178.101 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.487 -1.692 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 m -93.32 147.27 5.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 CA-C-O 120.712 0.292 . . . . 0.0 110.481 177.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.48 125.89 52.94 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 11.7 ptpt -161.82 102.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.605 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -2.99 6.27 Favored Glycine 0 N--CA 1.461 0.307 0 N-CA-C 116.081 1.193 . . . . 0.0 116.081 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.473 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 69.1 p-90 -74.03 -7.09 51.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.06 0.93 . . . . 0.0 111.079 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -55.28 -25.03 31.4 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -87.26 0.24 55.68 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.431 0.634 . . . . 0.0 111.725 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -106.7 7.05 30.27 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.711 0.767 . . . . 0.0 109.907 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.99 110.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.698 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.442 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.491 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -91.05 160.03 15.81 Favored 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -176.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -38.36 67.69 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.127 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.38 -39.16 85.62 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 120.901 0.381 . . . . 0.0 111.489 -177.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.08 -48.75 61.87 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.496 ' O ' HG21 ' A' ' 19' ' ' VAL . 4.6 ptm180 -68.3 -38.99 82.17 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.738 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.9 t -65.15 -29.85 70.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.746 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 66.2 t60 -69.64 -42.63 74.02 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.46 176.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.464 HD23 HD23 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -60.88 -38.68 86.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 15' ' ' ARG . 97.9 t -59.08 -51.04 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 121.296 0.569 . . . . 0.0 109.673 174.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -51.29 -47.88 62.44 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.576 1.15 . . . . 0.0 110.605 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.746 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 54.7 mttm -67.99 -37.86 81.98 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 86.9 mt -54.7 -42.88 72.01 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.69 -52.05 65.42 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.938 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.336 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -74.1 -14.51 60.99 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.711 -0.796 . . . . 0.0 112.936 -175.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.27 -46.27 15.02 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.757 173.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.558 HD11 ' CG2' ' B' ' 145' ' ' ILE . 5.0 tt -72.72 -28.93 28.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.618 0.723 . . . . 0.0 109.866 -177.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -132.59 92.57 26.95 Favored Pre-proline 0 N--CA 1.401 -2.894 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.216 -175.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.74 91.93 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.423 2.082 . . . . 0.0 107.928 170.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.5 123.23 78.12 Favored Pre-proline 0 N--CA 1.422 -1.872 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.893 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.03 -23.44 12.16 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.115 2.543 . . . . 0.0 111.683 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -143.87 143.04 21.62 Favored Pre-proline 0 CA--C 1.491 -1.302 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.28 -13.64 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 121.496 1.464 . . . . 0.0 110.697 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.32 -14.18 55.76 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.754 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.83 -12.14 60.31 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 122.047 0.927 . . . . 0.0 109.325 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 26.1 mt -83.98 0.61 47.32 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.464 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -133.18 19.01 4.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.91 0.862 . . . . 0.0 109.572 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.9 t70 -77.37 174.68 10.53 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.692 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -69.79 -27.41 64.88 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.327 0.585 . . . . 0.0 109.61 176.759 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 14.7 ttm180 -73.48 -21.3 60.46 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.297 0.57 . . . . 0.0 110.053 177.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.52 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -61.28 -40.34 93.74 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.491 177.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.0 pt-20 -62.56 -30.76 71.54 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 118.62 -1.232 . . . . 0.0 109.896 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.415 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -70.69 -48.5 54.39 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.71 1.204 . . . . 0.0 110.527 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.7 mt -67.92 -44.78 76.08 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.833 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.534 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 9.5 p -72.18 -32.34 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.414 -0.515 . . . . 0.0 109.93 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.62 -41.51 99.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.498 0.666 . . . . 0.0 109.319 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.507 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -60.56 -50.31 74.03 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.618 173.156 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.84 -40.57 88.96 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.989 0.423 . . . . 0.0 110.964 -177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.8 mttt -65.03 -48.27 74.46 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.301 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.535 ' CE ' ' HA ' ' B' ' 149' ' ' LEU . 15.0 pttp -63.8 -38.46 91.19 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 46' ' ' TYR . 55.2 t -64.43 -53.3 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.204 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -56.05 -46.81 78.79 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 124.09 0.869 . . . . 0.0 109.696 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.15 99.72 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.646 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -58.07 -53.27 60.1 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 123.292 0.637 . . . . 0.0 110.828 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.437 ' HB3' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.3 -32.92 74.22 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 178.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -64.66 -41.99 95.72 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 123.328 0.651 . . . . 0.0 109.56 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.43 -22.09 41.53 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.011 -0.431 . . . . 0.0 111.995 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.1 t -79.14 -54.18 6.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 160.08 14.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -171.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.59 -2.1 29.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.588 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.3 m -154.82 160.23 41.11 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -36.9 69.15 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 118.799 -1.16 . . . . 0.0 111.753 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.46 -38.14 83.22 Favored 'General case' 0 C--O 1.197 -1.66 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -47.09 77.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.299 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.09 91.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.518 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -55.98 -48.67 75.41 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 125.66 1.584 . . . . 0.0 109.12 175.167 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -61.25 -55.56 30.54 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 123.842 0.857 . . . . 0.0 111.851 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.437 HD13 ' HB3' ' A' ' 54' ' ' MET . 3.9 pp -68.61 -29.3 67.79 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 120.469 -0.493 . . . . 0.0 111.336 -175.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 0.9 OUTLIER -71.76 -40.94 69.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.516 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -59.13 -38.07 78.77 Favored 'General case' 0 C--O 1.203 -1.363 0 C-N-CA 123.463 0.705 . . . . 0.0 109.699 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 4.8 mm-40 -60.94 -50.08 74.87 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.188 0.995 . . . . 0.0 111.825 175.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.432 ' O ' HD11 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.77 -35.95 67.55 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 119.222 -0.991 . . . . 0.0 111.642 -177.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.631 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -67.93 -36.96 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.467 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.7 -54.23 40.87 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 124.976 1.311 . . . . 0.0 110.985 175.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HB3' ' HZ2' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -68.67 -32.29 72.01 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.195 -176.186 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.432 HD11 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -64.06 -43.8 97.61 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 59.8 mt-30 -63.17 -51.62 65.67 Favored 'General case' 0 CA--C 1.493 -1.241 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.903 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.1 ptpt -72.16 -27.61 62.7 Favored 'General case' 0 N--CA 1.402 -2.852 0 C-N-CA 119.048 -1.061 . . . . 0.0 112.911 -177.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -60.72 -52.87 63.26 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.669 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.1 pp -65.38 -35.67 81.67 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.97 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.75 -44.54 73.53 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -71.19 -34.77 71.21 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 121.973 -0.454 . . . . 0.0 111.479 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.494 ' NZ ' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -74.38 -32.62 62.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.354 178.275 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.509 ' HG2' ' HG ' ' B' ' 137' ' ' LEU . 29.4 tpt180 -70.3 -40.14 74.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' SER . 35.6 ttm180 -62.18 -35.58 79.28 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 174.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 62.0 m 77.72 73.45 0.06 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.442 177.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -101.8 -10.56 19.81 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.14 176.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 C--N 1.304 -1.384 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.435 176.897 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.336 0 N-CA-C 111.34 -0.704 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.0 m -77.94 97.22 5.25 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.163 0.506 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 56.9 ttp -108.66 -67.07 1.0 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 11.8 p -102.91 154.61 19.04 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -105.75 145.26 31.37 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.459 ' HA ' HE22 ' B' ' 109' ' ' GLN . 98.5 m-85 -124.71 133.53 53.16 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.66 -25.56 5.31 Favored Glycine 0 C--N 1.302 -1.347 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 20.0 p-10 -87.42 -19.31 28.24 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 113.956 -1.122 . . . . 0.0 113.93 -174.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.459 HE22 ' HA ' ' B' ' 106' ' ' TYR 0.381 0.0 OUTLIER -76.86 -11.73 59.86 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -178.059 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.3 m -69.85 -41.58 74.68 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.36 -40.13 74.21 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.845 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 25.1 mt-30 -61.87 -36.87 82.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.742 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -61.84 -46.88 87.57 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.734 0.646 . . . . 0.0 109.731 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.71 -47.2 74.01 Favored 'General case' 0 C--O 1.249 1.042 0 O-C-N 123.751 0.657 . . . . 0.0 110.081 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.484 HD23 ' CD ' ' A' ' 21' ' ' LYS . 85.8 mt -52.87 -62.05 1.9 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.532 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.517 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 7.3 t -69.08 -25.79 64.61 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.627 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -71.39 -52.12 20.32 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.406 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.511 ' HB2' ' NE2' ' A' ' 17' ' ' HIS . 54.1 m-20 -75.72 -31.97 59.86 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.676 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' B' ' 123' ' ' SER . 47.0 p -71.22 -54.79 9.72 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.058 -0.657 . . . . 0.0 111.894 -177.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.0 mt -80.9 -52.63 7.25 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 15.3 m -74.73 -48.31 26.44 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -82.8 -3.18 56.36 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.888 -0.507 . . . . 0.0 111.849 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' B' ' 119' ' ' SER . 67.7 p 53.44 42.99 31.92 Favored 'General case' 0 C--O 1.245 0.844 0 C-N-CA 124.812 1.245 . . . . 0.0 111.811 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 10.4 t70 68.13 -79.41 0.04 OUTLIER 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.459 1.104 . . . . 0.0 112.406 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 82.04 -53.25 4.73 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 112.076 -0.41 . . . . 0.0 112.076 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 73.76 19.2 79.72 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -110.29 23.66 20.11 Favored Glycine 0 N--CA 1.437 -1.253 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 40.7 m -85.05 109.11 17.99 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -122.3 10.48 9.31 Favored Glycine 0 CA--C 1.5 -0.868 0 C-N-CA 119.783 -1.199 . . . . 0.0 111.995 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -79.79 123.35 6.07 Favored Glycine 0 N--CA 1.431 -1.643 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 176.58 150.51 8.27 Favored Glycine 0 N--CA 1.422 -2.244 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.9 p -161.97 -60.17 0.05 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 76.29 -68.8 2.33 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.705 -0.68 . . . . 0.0 113.674 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 166.72 59.73 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 110.684 -0.966 . . . . 0.0 110.684 -177.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 84.53 -84.11 1.6 Allowed Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.2 p -155.25 131.69 10.41 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.509 ' HG ' ' HG2' ' A' ' 83' ' ' ARG . 5.5 mp -106.04 -25.2 12.16 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -169.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.429 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 1.3 mp0 -59.03 -61.41 2.66 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 123.852 0.72 . . . . 0.0 110.808 -174.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t 45.61 -101.34 0.05 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.544 1.138 . . . . 0.0 113.736 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -74.99 -20.1 59.8 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 123.827 0.851 . . . . 0.0 110.035 -176.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.669 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.5 ttt -71.22 -26.24 62.84 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.638 -177.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.481 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.7 mt-10 -57.1 -27.9 62.18 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.2 m -67.39 -46.77 72.3 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 120.791 0.329 . . . . 0.0 110.417 178.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -73.16 -27.73 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.726 0.774 . . . . 0.0 109.853 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.558 ' CG2' HD11 ' A' ' 26' ' ' ILE . 8.9 mm -66.77 -44.44 89.3 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.854 174.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.537 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 23.7 ttt180 -64.66 -37.32 87.16 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.367 0.417 . . . . 0.0 110.121 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 11.4 t -63.61 -43.68 96.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.75 -51.36 65.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.179 0.591 . . . . 0.0 111.65 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.537 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.4 pp -66.85 -24.52 66.15 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -176.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 24.3 ttt -59.86 -45.36 92.69 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.866 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -142.01 138.19 31.68 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.89 -173.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.053 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.528 178.985 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.644 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.0 m -80.59 133.68 28.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-O 121.35 0.595 . . . . 0.0 112.495 -178.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.88 75.65 1.9 Allowed 'General case' 0 N--CA 1.439 -1.007 0 CA-C-O 121.817 0.817 . . . . 0.0 110.935 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HD3' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ptpt -94.4 94.53 8.31 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.274 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.48 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.07 0.2 8.22 Favored Glycine 0 C--O 1.218 -0.852 0 CA-C-N 115.079 -0.964 . . . . 0.0 115.291 -173.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.484 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 69.9 p-90 -77.49 -4.21 44.43 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 122.119 -0.636 . . . . 0.0 110.851 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -59.8 -18.09 40.94 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.267 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 11.4 pt-20 -90.32 -10.84 42.61 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.065 0.46 . . . . 0.0 111.059 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 64.6 m-70 -99.93 6.13 45.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.466 0.651 . . . . 0.0 110.575 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.42 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.1 p -127.76 110.64 22.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-N 114.913 -1.039 . . . . 0.0 108.304 177.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 m -74.94 150.16 39.16 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.121 -175.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -58.59 -38.36 77.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.305 179.336 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.511 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 16.6 m-20 -67.29 -35.62 79.85 Favored 'General case' 0 C--O 1.197 -1.706 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.56 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.411 HD13 HG21 ' A' ' 10' ' ' VAL . 3.4 tm? -67.6 -50.04 60.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -63.23 -42.01 99.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.831 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.6 t -69.47 -30.35 68.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.666 0.746 . . . . 0.0 110.235 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.615 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 12.7 t60 -75.0 -35.44 62.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.378 -178.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mp -65.63 -37.76 87.46 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 174.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.5 t -57.29 -46.02 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.565 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.0 t-80 -55.96 -47.96 76.69 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.824 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.615 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 3.4 mptp? -64.14 -37.66 88.25 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 178.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -53.53 -47.24 70.14 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.424 ' CG1' ' HE3' ' A' ' 40' ' ' MET . 24.9 t -58.84 -50.85 77.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.218 173.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.2 mt-30 -60.46 -32.67 71.62 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.46 -43.34 19.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.503 HD12 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.55 -30.48 42.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 122.078 0.942 . . . . 0.0 109.552 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.561 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 75.9 t80 -127.95 86.26 58.6 Favored Pre-proline 0 N--CA 1.402 -2.873 0 CA-C-N 114.371 -1.286 . . . . 0.0 108.547 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.12 78.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.11 2.54 . . . . 0.0 109.678 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 t -59.28 136.94 88.62 Favored Pre-proline 0 N--CA 1.419 -2.0 0 CA-C-N 114.387 -1.278 . . . . 0.0 113.093 -173.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -75.66 -19.35 16.59 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.774 2.316 . . . . 0.0 111.513 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -160.89 142.61 9.06 Favored Pre-proline 0 CA--C 1.51 -0.594 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -53.41 -21.18 17.36 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 C-N-CA 122.884 2.389 . . . . 0.0 114.352 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.72 60.01 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 121.295 -0.878 . . . . 0.0 112.885 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.19 56.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.023 0.916 . . . . 0.0 109.209 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 40' ' ' MET . 19.4 mt -89.69 7.11 38.38 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.999 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -132.76 19.02 4.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.745 0.783 . . . . 0.0 109.373 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.594 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.8 t70 -82.84 175.51 10.03 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.295 -178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.579 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.62 -25.91 62.35 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.901 -0.499 . . . . 0.0 111.008 177.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.6 ttp180 -69.74 -21.44 63.46 Favored 'General case' 0 C--O 1.251 1.144 0 CA-C-O 121.79 0.805 . . . . 0.0 109.597 175.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.672 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.8 tpp -63.03 -41.36 99.51 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.345 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -59.57 -31.66 69.65 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.713 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.425 HD22 HD23 ' B' ' 149' ' ' LEU . 5.5 t30 -75.38 -45.84 36.67 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.004 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.39 -42.53 92.56 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.334 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.672 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.1 p -73.4 -31.15 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -60.01 -48.4 81.85 Favored 'General case' 0 C--N 1.35 0.588 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.465 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -58.92 -46.65 87.43 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.322 175.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.23 94.52 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.07 0.231 . . . . 0.0 110.892 -178.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -62.45 -47.64 83.14 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.465 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 16.3 pttp -65.44 -35.58 81.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.109 0.48 . . . . 0.0 110.412 -177.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.73 ' O ' ' HG2' ' A' ' 54' ' ' MET . 42.8 t -70.71 -51.06 39.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.759 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -57.23 -45.51 83.83 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.352 0.661 . . . . 0.0 110.189 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.34 -38.27 96.16 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.874 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -58.13 -50.8 72.22 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.73 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.7 OUTLIER -65.98 -43.24 88.44 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.931 -175.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -56.59 -42.07 78.07 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.874 0.869 . . . . 0.0 108.774 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.456 ' HA ' ' HZ1' ' A' ' 4' ' ' LYS . 12.5 mm-40 -83.2 -13.71 54.84 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.9 m -90.0 -24.76 21.15 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.642 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.99 164.48 11.79 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.586 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -125.22 19.08 8.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 m -158.78 153.85 25.25 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.56 -39.45 67.43 Favored 'General case' 0 C--O 1.191 -1.979 0 C-N-CA 118.954 -1.099 . . . . 0.0 111.532 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.96 -30.08 71.19 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -72.65 -49.8 29.36 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.811 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -42.48 98.56 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.434 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -57.75 -49.12 77.65 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 125.328 1.451 . . . . 0.0 109.781 174.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.524 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.3 t-80 -65.16 -50.86 64.33 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 123.223 0.327 . . . . 0.0 111.048 -173.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.6 pp -68.62 -30.99 69.83 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-O 120.991 0.424 . . . . 0.0 111.012 -176.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.7 pp -73.99 -35.54 64.45 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.454 ' HB3' HE22 ' B' ' 112' ' ' GLN . . . -64.79 -28.36 69.51 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.961 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 22.5 mm-40 -73.42 -42.58 61.88 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-O 120.994 0.426 . . . . 0.0 111.612 176.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.39 -37.45 74.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 118.626 -1.23 . . . . 0.0 110.632 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.585 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -68.77 -36.48 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.542 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 0.9 OUTLIER -51.4 -53.92 31.85 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.599 1.56 . . . . 0.0 110.801 173.508 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -67.08 -32.92 74.42 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.02 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.61 -42.98 97.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 123.045 0.215 . . . . 0.0 110.983 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.3 mt-30 -63.58 -52.25 61.78 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.567 0.699 . . . . 0.0 110.721 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 15.0 ptpt -71.05 -27.69 63.83 Favored 'General case' 0 N--CA 1.415 -2.179 0 C-N-CA 119.289 -0.964 . . . . 0.0 112.21 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.9 tp10 -59.98 -52.52 65.06 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -61.83 -42.13 98.65 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.791 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -59.26 -53.46 58.02 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.248 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -70.42 -37.04 74.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.431 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -69.96 -35.76 74.71 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.051 -175.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.431 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 11.3 tpt180 -77.04 -35.87 56.5 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.149 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -78.21 -60.11 2.5 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.676 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.5 m 170.58 87.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.758 1.623 . . . . 0.0 111.529 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -103.21 -23.83 13.6 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.199 -1.0 . . . . 0.0 109.176 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 C--O 1.25 1.125 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.795 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.954 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 48.2 m -75.38 114.24 13.7 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 115.18 -0.51 . . . . 0.0 111.148 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 20.0 mmt -95.04 159.96 14.78 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 11.6 m 63.84 24.75 13.84 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -173.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -83.18 108.01 16.13 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.906 -173.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -116.91 58.72 0.77 Allowed 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.309 174.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -90.62 52.64 3.36 Favored Glycine 0 CA--C 1.48 -2.122 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.154 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 37.4 p-10 -99.15 -1.75 38.6 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 113.813 -1.194 . . . . 0.0 110.39 -176.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER -53.4 -49.92 66.26 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -178.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 9.0 t -68.43 -27.14 65.93 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.78 -50.11 32.82 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.454 HE22 ' HB3' ' A' ' 69' ' ' ALA . 81.1 mm-40 -61.18 -44.37 97.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.609 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.22 -46.79 88.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.036 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.83 -41.7 78.31 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 20.8 mt -60.34 -62.16 2.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.433 176.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 11.1 t -63.76 -26.76 68.79 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -74.86 -56.29 4.92 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.856 0.36 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.1 -41.49 50.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 29.8 t -68.47 -54.62 15.79 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -173.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.56 -33.6 75.95 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 15.5 m -71.38 -38.64 71.5 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.726 0.298 . . . . 0.0 110.291 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -67.73 -39.36 84.29 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 44.2 t -69.31 -7.54 38.0 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-N 114.668 -1.151 . . . . 0.0 112.221 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -126.78 -54.23 1.42 Allowed 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.733 -175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -112.95 -150.3 10.77 Favored Glycine 0 N--CA 1.438 -1.228 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.88 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -91.29 5.65 80.98 Favored Glycine 0 N--CA 1.439 -1.156 0 C-N-CA 121.654 -0.308 . . . . 0.0 112.774 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -56.86 118.68 12.57 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 4.9 p -152.3 120.39 6.24 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -177.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -135.54 176.92 19.83 Favored Glycine 0 N--CA 1.419 -2.458 0 C-N-CA 119.828 -1.177 . . . . 0.0 112.549 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -141.29 174.36 22.9 Favored Glycine 0 N--CA 1.416 -2.643 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -171.72 -160.55 20.52 Favored Glycine 0 N--CA 1.427 -1.926 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.9 m 69.28 152.71 0.1 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.605 1.162 . . . . 0.0 112.892 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -175.57 58.98 0.11 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 176.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -91.86 -132.09 5.56 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.889 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 134.07 88.1 0.31 Allowed Glycine 0 N--CA 1.438 -1.194 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.7 m 79.37 6.41 2.03 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 124.947 1.299 . . . . 0.0 113.516 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 59.2 mt -76.88 -35.14 57.64 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 173.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.561 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 1.4 mp0 -58.33 -40.77 82.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.189 176.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 71.4 m -70.99 -12.52 61.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.742 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -80.48 -34.9 35.47 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 92.2 mmm -80.96 -30.61 35.11 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.665 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' B' ' 138' ' ' GLU 0.285 43.7 mt-10 -47.16 -27.78 1.57 Allowed 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -173.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -73.82 -49.59 24.47 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 119.156 0.889 . . . . 0.0 110.897 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -73.4 -24.4 20.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-O 122.272 1.034 . . . . 0.0 110.079 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.503 ' CG2' HD12 ' A' ' 26' ' ' ILE . 12.7 mm -70.75 -35.51 60.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.539 172.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.464 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 38.7 ttt180 -59.08 -40.98 86.93 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.8 m -57.68 -53.34 59.27 Favored 'General case' 0 CA--C 1.553 1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.641 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -66.06 -38.64 88.85 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.1 pp -73.93 -31.45 63.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.428 ' N ' HD12 ' B' ' 149' ' ' LEU . 39.7 tpp -67.51 -34.94 78.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.8 t70 75.55 -50.55 0.64 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.621 1.568 . . . . 0.0 112.446 171.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.436 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.622 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.209 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.34 97.59 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.175 0 CA-C-O 123.14 1.447 . . . . 0.0 113.447 -176.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -120.01 31.31 6.58 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 113.291 -1.777 . . . . 0.0 107.049 177.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.638 ' HD3' ' CE2' ' A' ' 6' ' ' TRP . 16.0 ptpt -137.33 126.32 24.28 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 113.646 -1.615 . . . . 0.0 109.907 -171.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.6 -18.53 79.73 Favored Glycine 0 C--N 1.316 -0.572 0 N-CA-C 114.366 0.507 . . . . 0.0 114.366 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.638 ' CE2' ' HD3' ' A' ' 4' ' ' LYS . 69.2 p-90 -67.27 -6.07 16.81 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -61.64 -30.65 70.85 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 120.861 0.362 . . . . 0.0 111.067 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -71.85 -21.98 61.59 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.376 0.608 . . . . 0.0 111.318 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -87.43 -33.03 19.21 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.888 -176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.511 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.6 p -87.54 110.5 20.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.993 0.901 . . . . 0.0 109.788 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -71.53 149.54 45.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.908 -176.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -37.58 82.57 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -56.79 -42.64 79.84 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.287 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.32 -52.03 21.02 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.763 0.792 . . . . 0.0 109.167 -173.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.508 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.8 ptm180 -64.48 -38.5 91.24 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.239 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 t -73.9 -23.98 59.64 Favored 'General case' 0 N--CA 1.424 -1.765 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -70.94 -37.5 72.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -40.22 94.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.394 174.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 15' ' ' ARG . 83.9 t -58.84 -45.97 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.364 0.666 . . . . 0.0 109.652 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -55.47 -47.29 76.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.173 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HD3' HD22 ' B' ' 115' ' ' LEU . 35.7 mttp -66.21 -36.87 84.17 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.312 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.4 mt -56.41 -45.39 80.71 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 123.241 0.338 . . . . 0.0 110.188 174.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -48.87 83.98 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 O-C-N 123.772 0.67 . . . . 0.0 111.813 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -71.76 -23.58 61.62 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.502 -176.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.34 21.98 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.406 176.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.528 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.52 -34.36 57.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.419 ' CD2' ' HG2' ' B' ' 138' ' ' GLU . 2.0 m-85 -127.61 87.09 56.88 Favored Pre-proline 0 N--CA 1.41 -2.467 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.623 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -68.06 77.3 0.62 Allowed 'Trans proline' 0 C--O 1.262 1.685 0 C-N-CA 122.5 2.133 . . . . 0.0 108.61 168.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.4 t -54.88 143.95 49.29 Favored Pre-proline 0 N--CA 1.427 -1.621 0 CA-C-N 113.444 -1.707 . . . . 0.0 113.142 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.32 -36.31 28.18 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.264 1.976 . . . . 0.0 110.66 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -149.03 142.13 15.77 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -53.81 -21.12 19.27 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.256 2.637 . . . . 0.0 115.307 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.83 -11.06 59.66 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 121.035 -1.041 . . . . 0.0 112.468 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.44 -12.86 60.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.181 0.991 . . . . 0.0 108.758 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -84.2 7.23 19.72 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.463 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -132.98 20.41 4.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.766 0.793 . . . . 0.0 109.791 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.572 ' O ' ' HB3' ' A' ' 40' ' ' MET . 35.4 t70 -86.86 174.97 8.42 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.82 -25.22 67.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.944 0.402 . . . . 0.0 110.375 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.491 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.9 ttm180 -65.56 -31.37 72.38 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.572 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 10.2 tpp -60.73 -39.27 88.01 Favored 'General case' 0 CA--C 1.496 -1.128 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.099 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -33.67 76.51 Favored 'General case' 0 C--O 1.199 -1.555 0 C-N-CA 117.381 -1.727 . . . . 0.0 110.048 -177.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -66.59 -46.29 76.43 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 124.039 0.837 . . . . 0.0 110.386 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 85.8 mt -65.72 -47.05 76.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.928 -177.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.475 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.6 p -73.27 -31.87 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.1 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.09 94.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.497 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -60.12 -47.41 86.01 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 124.208 1.003 . . . . 0.0 110.322 174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.15 -45.24 94.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.773 -0.194 . . . . 0.0 110.738 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -62.85 -40.04 96.24 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.881 0.472 . . . . 0.0 111.474 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 48.4 pttt -73.55 -36.37 65.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.862 0.363 . . . . 0.0 110.979 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.4 -45.92 84.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -54.98 -47.85 74.03 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.831 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.77 97.1 Favored Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.793 -0.64 . . . . 0.0 113.206 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.63 -54.32 48.41 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.762 0.315 . . . . 0.0 110.962 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.529 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 1.8 ptp -70.17 -30.88 68.13 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -60.99 -49.59 76.81 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HA ' ' NZ ' ' A' ' 4' ' ' LYS . 6.1 mm-40 -73.3 -24.31 60.39 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.46 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 37.9 m -76.16 -34.46 59.37 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.852 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.5 164.72 14.69 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.138 0.494 . . . . 0.0 111.967 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.04 15.37 13.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.001 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.5 m -158.4 150.48 21.65 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.511 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.38 -34.34 67.87 Favored 'General case' 0 C--O 1.187 -2.19 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.319 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -69.39 -32.24 71.12 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.874 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 11.9 tp10 -66.56 -51.68 53.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -39.25 92.23 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.784 -177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.65 ' CE1' HD12 ' B' ' 115' ' ' LEU . 11.9 t80 -61.46 -47.13 87.09 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.145 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.57 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 55.8 m80 -70.68 -43.54 68.84 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.529 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.6 pp -68.53 -31.09 70.07 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 120.379 -0.528 . . . . 0.0 112.186 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.493 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.7 OUTLIER -74.48 -39.27 62.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.447 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -54.22 -40.82 68.0 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.681 173.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 45.7 mm-40 -60.16 -48.56 81.23 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.511 0.672 . . . . 0.0 110.577 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 1.6 tptt -62.09 -48.31 80.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.322 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.573 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -34.34 67.35 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.186 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.453 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 5.4 t80 -55.5 -53.52 55.34 Favored 'General case' 0 C--O 1.257 1.477 0 C-N-CA 125.348 1.459 . . . . 0.0 110.943 174.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.7 ptpt -64.35 -34.36 77.97 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.717 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.75 -43.95 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 123.326 0.391 . . . . 0.0 110.49 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.8 mt-30 -64.59 -52.12 59.17 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.9 -176.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.0 ptpt -71.16 -29.05 64.72 Favored 'General case' 0 N--CA 1.419 -1.997 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.1 -177.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 82' ' ' LYS . 48.9 tp10 -63.22 -51.77 64.9 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.506 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -64.0 -39.72 94.76 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -68.52 -44.37 74.76 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.7 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -69.17 -45.15 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 119.869 -0.732 . . . . 0.0 112.199 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 78' ' ' GLU . 0.0 OUTLIER -73.57 -33.73 64.79 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -177.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.44 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 3.4 tmt_? -77.03 -41.25 43.32 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.125 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.445 ' O ' ' HB2' ' A' ' 85' ' ' SER . 59.4 ttt180 -66.32 -60.65 2.57 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.663 -178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 13.8 t 162.58 118.82 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 82' ' ' LYS . 29.6 ptt180 -139.93 -19.59 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.039 171.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 C--O 1.256 1.419 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.547 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.868 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.8 m -77.81 -51.17 10.93 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 23.7 mmt 57.64 77.68 0.27 Allowed 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.534 1.134 . . . . 0.0 111.235 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 13.1 t -110.23 -51.94 2.82 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.976 -0.69 . . . . 0.0 109.27 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -96.11 8.63 43.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.95 0.881 . . . . 0.0 109.955 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -135.98 131.11 34.64 Favored 'General case' 0 N--CA 1.414 -2.234 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 173.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.83 -21.23 18.88 Favored Glycine 0 C--N 1.296 -1.689 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -175.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -81.27 -19.56 42.76 Favored 'General case' 0 C--N 1.281 -2.37 0 CA-C-N 113.747 -1.227 . . . . 0.0 112.414 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.479 ' HA ' ' OE1' ' B' ' 112' ' ' GLN . 4.8 pm0 -68.79 -32.59 72.43 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 41.1 m -59.12 -49.32 78.33 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.123 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.36 -53.12 48.17 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.481 -176.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.479 ' OE1' ' HA ' ' B' ' 109' ' ' GLN 0.366 0.0 OUTLIER -75.3 -27.61 59.4 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -176.552 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -73.68 -42.21 61.6 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.483 175.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.54 -45.78 90.79 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.65 HD12 ' CE1' ' A' ' 65' ' ' TYR . 9.0 mt -50.01 -61.77 1.96 Allowed 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.494 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -62.32 -42.29 99.25 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.623 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 41.9 m -63.94 -37.39 87.25 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.307 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -77.06 -53.1 8.21 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.4 m -62.31 -54.39 41.24 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -171.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 86.9 mt -74.14 -24.97 59.5 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.91 -0.716 . . . . 0.0 112.466 -174.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 17.7 m -75.87 -31.44 59.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -65.7 -50.73 63.8 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 46.0 m -59.63 -41.2 89.92 Favored 'General case' 0 C--O 1.239 0.512 0 O-C-N 123.663 0.602 . . . . 0.0 111.317 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.15 -43.94 98.09 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.443 0.639 . . . . 0.0 110.484 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 151.79 80.89 0.03 OUTLIER Glycine 0 N--CA 1.415 -2.703 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -151.62 163.83 30.09 Favored Glycine 0 N--CA 1.423 -2.172 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -115.59 45.55 1.28 Allowed Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.2 m -62.26 103.56 0.4 Allowed 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 123.617 0.767 . . . . 0.0 110.275 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 175.62 48.72 0.06 OUTLIER Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -137.39 94.65 0.22 Allowed Glycine 0 N--CA 1.428 -1.888 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -179.22 55.78 0.09 OUTLIER Glycine 0 C--N 1.3 -1.448 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -97.47 126.57 42.82 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 162.08 173.06 30.3 Favored Glycine 0 C--N 1.298 -1.568 0 C-N-CA 119.865 -1.16 . . . . 0.0 112.18 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 154.26 -43.87 0.59 Allowed Glycine 0 N--CA 1.432 -1.589 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 92.68 36.8 5.99 Favored Glycine 0 N--CA 1.439 -1.141 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.572 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 68.7 m 61.34 80.01 0.23 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 5.5 mp -102.56 -16.38 16.12 Favored 'General case' 0 C--O 1.245 0.855 0 CA-C-O 122.274 1.035 . . . . 0.0 108.467 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.49 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -64.88 -23.49 67.25 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.746 -1.57 . . . . 0.0 112.415 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 7.2 p -48.41 -30.33 4.92 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.747 1.219 . . . . 0.0 113.967 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -105.4 -14.04 15.45 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 121.837 0.827 . . . . 0.0 110.439 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.592 ' O ' HG12 ' B' ' 145' ' ' ILE . 7.7 tpt -81.0 -27.74 35.76 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.708 0.765 . . . . 0.0 109.117 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 50.4 mt-10 -52.57 -27.22 15.86 Favored 'General case' 0 C--O 1.199 -1.586 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.9 p -58.06 -59.96 4.47 Favored 'General case' 0 C--O 1.265 1.87 0 CA-C-O 122.083 0.944 . . . . 0.0 110.926 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.51 HD13 ' SD ' ' B' ' 141' ' ' MET . 41.8 pt -64.61 -29.93 48.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.61 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.592 HG12 ' O ' ' B' ' 141' ' ' MET . 17.7 mm -67.25 -40.56 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.007 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 99.1 mtt180 -59.58 -42.01 91.56 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.2 m -58.07 -47.36 83.41 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.903 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.82 -38.4 73.28 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.492 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -71.09 -31.19 67.5 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.752 -0.592 . . . . 0.0 110.369 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -76.81 -58.56 3.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.277 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -114.28 95.3 5.21 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.329 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.056 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 177.322 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.83 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.2 t -93.52 102.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.536 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.04 124.96 52.96 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.03 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -120.32 142.89 48.7 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.595 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.1 -28.0 57.98 Favored Glycine 0 N--CA 1.473 1.111 0 N-CA-C 114.93 0.732 . . . . 0.0 114.93 -172.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.4 p-90 -72.32 -9.62 58.73 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.71 -15.72 54.09 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 10.9 pt-20 -89.09 -9.3 51.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.288 0.566 . . . . 0.0 110.086 177.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.0 m-70 -96.24 4.23 52.52 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.272 0.558 . . . . 0.0 109.77 -178.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.503 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 1.1 t -118.46 113.0 40.52 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.412 0 N-CA-C 104.716 -2.328 . . . . 0.0 104.716 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.0 m -65.98 149.93 49.46 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -57.35 -39.98 77.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.334 0.588 . . . . 0.0 109.503 177.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.1 m-20 -63.96 -35.01 79.29 Favored 'General case' 0 C--O 1.196 -1.719 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.04 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.39 -51.44 15.02 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.457 ' O ' HG22 ' A' ' 19' ' ' VAL . 11.9 ptm180 -59.41 -42.74 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.106 0.479 . . . . 0.0 111.278 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.413 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 21.2 t -73.0 -24.84 60.8 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.36 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.583 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 10.3 t60 -74.94 -34.8 62.13 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.339 0.59 . . . . 0.0 109.749 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.0 mp -63.82 -39.14 93.53 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 173.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.457 HG22 ' O ' ' A' ' 15' ' ' ARG . 95.8 t -59.05 -49.68 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-O 121.667 0.746 . . . . 0.0 109.464 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.459 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 28.5 t-80 -51.29 -49.46 61.24 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.925 1.29 . . . . 0.0 111.098 177.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.583 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 55.2 mttm -64.77 -36.87 85.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.395 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.1 -47.51 77.92 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.389 0.431 . . . . 0.0 110.222 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.88 -49.15 84.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 O-C-N 123.769 0.668 . . . . 0.0 112.007 176.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -70.0 -23.21 63.11 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.449 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -81.2 -44.23 18.13 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.472 176.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.554 HD13 ' CG2' ' B' ' 145' ' ' ILE . 4.9 tt -70.73 -32.99 51.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.477 0.656 . . . . 0.0 110.149 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -127.62 93.57 39.98 Favored Pre-proline 0 N--CA 1.416 -2.155 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.1 -177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.553 ' O ' ' HA3' ' B' ' 133' ' ' GLY . 28.3 Cg_endo -66.86 96.42 0.37 Allowed 'Trans proline' 0 N--CA 1.446 -1.32 0 C-N-CA 121.794 1.663 . . . . 0.0 108.141 170.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.477 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 11.0 t -74.35 139.17 75.01 Favored Pre-proline 0 N--CA 1.419 -1.978 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.992 -171.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 -28.62 5.83 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.241 2.627 . . . . 0.0 111.717 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -140.23 146.23 44.99 Favored Pre-proline 0 CA--C 1.483 -1.629 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 -177.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -67.26 -12.58 36.43 Favored 'Trans proline' 0 C--N 1.323 -0.774 0 C-N-CA 121.411 1.408 . . . . 0.0 110.787 174.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.15 57.65 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.745 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.477 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -77.84 -11.8 59.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.101 0.953 . . . . 0.0 108.654 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.548 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.8 mt -87.79 3.82 46.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.828 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -133.04 21.52 4.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.697 0.761 . . . . 0.0 109.532 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 40' ' ' MET . 17.4 t70 -89.08 172.24 9.25 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.716 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.23 -25.76 65.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.419 0.628 . . . . 0.0 110.928 -178.788 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 -76.74 -16.21 59.55 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.613 0.72 . . . . 0.0 109.56 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.552 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.5 tpp -65.5 -40.31 92.9 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.182 176.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.5 pt-20 -62.09 -27.88 69.22 Favored 'General case' 0 C--O 1.192 -1.921 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.055 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.48 -47.41 55.67 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.196 0.598 . . . . 0.0 110.565 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.25 -45.96 75.15 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.426 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.494 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -72.6 -30.74 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.141 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.43 94.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.438 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.6 t80 -56.92 -46.59 81.89 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.675 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.78 -47.8 81.91 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.441 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -62.59 -40.11 95.85 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.14 0.576 . . . . 0.0 112.362 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.438 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.8 pttp -72.51 -38.32 68.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.809 0.338 . . . . 0.0 110.681 -177.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.6 t -69.28 -47.08 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -58.71 -47.6 84.02 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.663 0.785 . . . . 0.0 109.34 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.51 -39.73 93.49 Favored Glycine 0 C--O 1.224 -0.507 0 O-C-N 123.644 0.59 . . . . 0.0 112.667 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -59.84 -54.75 42.56 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.946 0.403 . . . . 0.0 111.19 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.457 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -66.74 -32.54 73.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.382 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.29 -49.78 76.25 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 123.902 0.881 . . . . 0.0 109.706 173.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.43 -21.08 60.56 Favored 'General case' 0 C--N 1.31 -1.152 0 O-C-N 122.033 -0.417 . . . . 0.0 111.986 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -84.55 -39.46 18.76 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.63 169.76 15.91 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -174.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.35 6.49 16.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.685 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -164.34 151.57 11.71 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.503 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -63.46 -35.77 81.54 Favored 'General case' 0 C--O 1.178 -2.676 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.141 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.17 -36.15 82.66 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 123.923 0.764 . . . . 0.0 110.379 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -71.81 -46.66 57.43 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.826 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -40.42 95.81 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.523 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.503 ' HH ' ' HB ' ' B' ' 116' ' ' THR . 0.3 OUTLIER -56.15 -49.91 72.65 Favored 'General case' 0 C--O 1.209 -1.045 0 C-N-CA 125.13 1.372 . . . . 0.0 109.369 174.499 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 35.9 t-80 -64.58 -54.16 36.39 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.419 -172.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 HD12 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.82 -29.97 69.26 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.447 -177.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.457 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -74.02 -38.26 64.11 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.725 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.7 -32.34 73.41 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 123.398 0.437 . . . . 0.0 109.838 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 12.1 mm-40 -70.85 -41.56 71.29 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 176.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -37.59 66.65 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 118.954 -1.098 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.581 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.7 tt -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.529 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.85 -54.12 38.92 Favored 'General case' 0 C--O 1.252 1.205 0 C-N-CA 125.004 1.321 . . . . 0.0 111.269 174.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -67.91 -34.81 77.35 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.911 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.97 -42.81 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 123.558 0.536 . . . . 0.0 110.476 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.4 mt-30 -61.82 -57.02 13.43 Favored 'General case' 0 CA--C 1.484 -1.567 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.081 -178.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -66.23 -32.5 73.96 Favored 'General case' 0 N--CA 1.418 -2.057 0 C-N-CA 119.78 -0.768 . . . . 0.0 112.839 -176.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -59.45 -52.68 64.56 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.462 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -68.2 -41.7 80.96 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.964 -177.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.7 -43.34 99.05 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.6 pt-20 -75.5 -36.66 60.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.657 -177.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.512 ' HZ2' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -71.5 -28.37 63.87 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -77.0 -43.12 35.93 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.807 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -75.67 -61.03 2.06 Favored 'General case' 0 C--O 1.247 0.959 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.446 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p 168.96 90.37 0.0 OUTLIER 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.854 0.862 . . . . 0.0 111.652 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -108.83 -23.38 11.77 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--O 1.256 1.418 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.434 -179.621 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.705 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 4.7 p -86.51 120.17 27.55 Favored 'General case' 0 N--CA 1.426 -1.671 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.5 ptm -106.82 -6.36 17.76 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.12 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.6 m 54.23 64.66 1.75 Allowed 'General case' 0 C--O 1.243 0.745 0 O-C-N 124.126 0.891 . . . . 0.0 110.185 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -76.49 107.99 9.15 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.873 0.844 . . . . 0.0 112.177 -175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -150.58 120.45 7.11 Favored 'General case' 0 N--CA 1.426 -1.635 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.858 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.46 -25.32 6.46 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -107.28 -10.58 15.77 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 -173.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -60.54 -37.57 81.63 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 123.517 0.51 . . . . 0.0 110.442 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.453 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 1.7 t -59.15 -48.44 81.6 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.005 177.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.42 -48.29 56.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -60.66 -43.76 97.26 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.291 0.369 . . . . 0.0 111.107 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.71 -38.58 80.35 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.176 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' B' ' 110' ' ' THR . 81.7 mt -63.16 -38.89 92.97 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.294 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -56.7 -66.58 0.42 Allowed 'General case' 0 C--O 1.214 -0.808 0 O-C-N 123.362 0.414 . . . . 0.0 110.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.503 ' HB ' ' HH ' ' A' ' 65' ' ' TYR . 9.0 t -56.96 -46.94 81.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -173.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.1 t -72.21 -46.82 54.6 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.994 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -76.58 -36.34 57.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.53 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 72.6 p -62.66 -48.86 77.51 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.87 -15.28 59.75 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.478 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 17.0 t -76.86 -58.19 3.42 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.286 0.565 . . . . 0.0 109.745 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -76.35 -38.88 55.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.867 -178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 16.8 m 63.7 -84.59 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.023 1.329 . . . . 0.0 113.276 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.12 -39.1 85.09 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.235 0.614 . . . . 0.0 112.139 -176.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 177.44 -65.81 0.09 OUTLIER Glycine 0 CA--C 1.486 -1.739 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.93 -85.49 1.56 Allowed Glycine 0 N--CA 1.428 -1.896 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.628 177.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 163.24 -113.71 0.57 Allowed Glycine 0 N--CA 1.42 -2.41 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.356 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 38.3 m 67.33 27.88 8.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.551 1.14 . . . . 0.0 110.446 -176.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -132.76 41.41 1.49 Allowed Glycine 0 N--CA 1.436 -1.348 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.807 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.68 -24.17 77.15 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.667 -0.267 . . . . 0.0 112.882 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 145.16 107.03 0.53 Allowed Glycine 0 N--CA 1.433 -1.555 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.515 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 55.8 m -150.48 31.87 0.65 Allowed 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.593 0.711 . . . . 0.0 109.44 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . 0.553 ' HA3' ' O ' ' A' ' 28' ' ' PRO . . . -150.45 49.7 0.55 Allowed Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.126 -1.189 . . . . 0.0 110.126 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -80.25 74.31 2.35 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 -178.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 155.41 -174.68 33.49 Favored Glycine 0 N--CA 1.422 -2.282 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 7.3 p -89.93 96.29 10.61 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 117.661 0.73 . . . . 0.0 111.227 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.41 -51.26 3.05 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.263 1.03 . . . . 0.0 108.754 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -16.91 58.58 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.851 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 46.1 t -51.57 -46.26 63.38 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.338 0.655 . . . . 0.0 111.951 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . 0.439 ' CB ' ' HE3' ' A' ' 82' ' ' LYS . 16.8 m-20 -82.1 -23.83 35.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.144 0.497 . . . . 0.0 111.103 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.618 ' SD ' HD12 ' B' ' 144' ' ' ILE . 13.9 tpt -76.38 -30.45 57.54 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.295 0.569 . . . . 0.0 109.617 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.537 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.4 mt-10 -49.66 -26.46 3.71 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.3 p -60.31 -59.47 5.36 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 121.362 0.601 . . . . 0.0 111.534 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.618 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.6 pp -70.78 -24.94 25.4 Favored 'Isoleucine or valine' 0 C--O 1.264 1.826 0 CA-C-O 122.28 1.038 . . . . 0.0 111.469 177.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.554 ' CG2' HD13 ' A' ' 26' ' ' ILE . 15.2 mm -65.1 -39.29 85.1 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.201 172.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -65.52 -40.7 93.27 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.885 177.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 5.2 p -60.75 -28.87 69.03 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.919 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -79.56 -52.23 8.27 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 119.13 -1.028 . . . . 0.0 112.198 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 2.4 pp -72.88 -23.12 60.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 17.0 tpt -76.17 -22.7 55.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 109.928 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -94.88 167.92 11.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.422 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.729 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.8 m -73.77 155.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.0 71.47 0.74 Allowed 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.595 1.188 . . . . 0.0 110.582 176.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.488 ' HD3' ' CZ2' ' A' ' 6' ' ' TRP . 16.1 ptpt -162.41 101.28 1.07 Allowed 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.692 -178.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -15.64 47.59 Favored Glycine 0 N--CA 1.468 0.782 0 N-CA-C 115.578 0.991 . . . . 0.0 115.578 -172.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.488 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 67.5 p-90 -67.46 -9.2 39.68 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.442 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -67.09 -17.73 65.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.188 0.518 . . . . 0.0 110.765 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.87 -10.0 59.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 121.243 0.544 . . . . 0.0 109.794 176.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.436 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 15.6 m-70 -96.72 4.55 51.76 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.48 -178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.408 HG22 HD12 ' A' ' 14' ' ' LEU . 7.5 p -138.09 110.66 6.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-O 122.068 0.937 . . . . 0.0 109.363 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -86.63 162.92 17.7 Favored 'General case' 0 N--CA 1.414 -2.245 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.788 -177.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.85 -36.85 77.71 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.754 -178.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -57.25 -45.5 83.93 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.411 HD22 ' HB3' ' B' ' 119' ' ' SER . 3.3 tm? -69.61 -50.98 39.24 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.718 0.771 . . . . 0.0 108.945 -175.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.537 ' O ' HG21 ' A' ' 19' ' ' VAL . 4.5 ptm180 -66.41 -41.35 89.4 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.064 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.5 t -70.79 -25.36 62.85 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.431 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 46.9 t60 -67.66 -40.55 84.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.433 HD13 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -65.32 -36.12 83.06 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.078 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.537 HG21 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -59.55 -44.73 93.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 123.521 0.728 . . . . 0.0 109.358 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.431 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.8 t-80 -58.77 -42.34 88.71 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.127 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.529 ' NZ ' ' HB2' ' B' ' 118' ' ' ASP . 72.7 mttt -71.27 -36.32 71.68 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.1 mt -57.02 -44.09 82.49 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.9 t -58.01 -50.41 78.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 O-C-N 124.117 0.886 . . . . 0.0 111.827 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.65 -17.67 62.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.62 -46.33 13.42 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.452 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.56 HD12 ' CG2' ' B' ' 145' ' ' ILE . 4.4 tt -70.69 -36.79 66.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 122.05 0.929 . . . . 0.0 108.925 -177.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.452 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 5.5 m-85 -130.16 88.06 49.27 Favored Pre-proline 0 N--CA 1.397 -3.087 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.624 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -61.6 94.44 0.12 Allowed 'Trans proline' 0 N--CA 1.438 -1.74 0 C-N-CA 121.878 1.719 . . . . 0.0 108.489 173.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -68.72 136.75 90.26 Favored Pre-proline 0 N--CA 1.401 -2.923 0 CA-C-N 113.883 -1.508 . . . . 0.0 111.68 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.18 -32.52 4.06 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.511 2.141 . . . . 0.0 110.612 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -137.46 146.27 52.88 Favored Pre-proline 0 CA--C 1.482 -1.659 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.122 -174.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -68.5 -11.45 31.98 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.626 1.551 . . . . 0.0 111.446 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.88 -9.23 54.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.57 -13.41 59.92 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.57 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.3 mt -84.53 7.24 20.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 113.921 -1.49 . . . . 0.0 110.612 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -131.87 14.04 4.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.756 0.789 . . . . 0.0 109.613 176.038 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.552 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.6 t70 -81.16 171.04 15.38 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.526 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -64.18 -28.57 69.84 Favored 'General case' 0 C--N 1.31 -1.129 0 O-C-N 122.14 -0.35 . . . . 0.0 111.289 -179.157 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.452 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 19.7 ttm180 -70.3 -20.16 63.04 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 35' ' ' LEU . 7.7 tpp -63.84 -42.87 97.5 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.444 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.48 -33.87 73.22 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.86 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -68.69 -48.21 64.48 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.48 -42.08 83.53 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.032 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.563 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.0 p -73.09 -33.55 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -62.07 -48.82 78.49 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 175.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.549 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 1.7 t80 -56.28 -42.89 78.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.099 0.96 . . . . 0.0 110.512 174.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.14 -38.46 78.83 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.986 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.3 mttm -64.36 -39.57 94.14 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 120.67 0.271 . . . . 0.0 111.364 177.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 4.3 ptmt -68.0 -44.14 77.25 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.477 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.2 t -62.32 -50.44 79.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -56.31 -50.06 72.53 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.371 1.068 . . . . 0.0 109.26 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.78 -32.78 80.35 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.137 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -70.07 -49.34 52.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.932 0.396 . . . . 0.0 110.732 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.411 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.5 OUTLIER -65.8 -30.33 70.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 177.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.442 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 78.1 t80 -61.75 -42.35 98.85 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 3.4 mm-40 -82.03 -13.27 57.61 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 t -87.63 -27.14 22.67 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-O 121.105 0.479 . . . . 0.0 110.56 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -95.55 165.83 12.15 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -116.54 8.52 13.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.709 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.0 p -158.42 156.66 30.81 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -32.94 67.35 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.853 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.78 -37.63 88.27 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 178.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -64.96 -47.47 77.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.903 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -40.99 98.32 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.048 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.689 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 7.0 t80 -64.01 -42.98 96.98 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.161 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.48 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.4 m80 -62.77 -57.21 11.73 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.05 176.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.23 -30.22 71.29 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -173.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 1.0 OUTLIER -72.36 -46.51 55.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 175.606 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' A' ' 73' ' ' TYR . . . -53.86 -34.27 58.88 Favored 'General case' 0 C--O 1.207 -1.16 0 O-C-N 123.825 0.703 . . . . 0.0 110.809 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.696 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 14.1 mt-10 -74.09 -45.35 49.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -67.72 -37.69 82.58 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.944 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.544 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 2.4 tt -69.31 -35.67 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.696 ' CD2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -69.45 -38.54 77.82 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.286 -178.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -68.19 -33.29 74.16 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.386 0.428 . . . . 0.0 110.068 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.66 -41.45 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.066 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 49.7 mt-30 -65.37 -45.43 84.12 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 120.957 0.408 . . . . 0.0 110.617 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.5 ptpt -71.41 -26.98 62.99 Favored 'General case' 0 N--CA 1.424 -1.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.72 -47.02 73.66 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -66.38 -34.42 77.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.084 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -65.66 -53.32 42.96 Favored 'General case' 0 N--CA 1.407 -2.579 0 C-N-CA 124.007 0.923 . . . . 0.0 110.314 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -62.29 -38.18 88.38 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.482 ' HE2' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -71.51 -31.16 66.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.026 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.431 ' HA ' ' NE ' ' A' ' 83' ' ' ARG . 1.0 OUTLIER -77.12 -42.45 37.9 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.601 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.446 ' O ' ' HB2' ' A' ' 85' ' ' SER . 23.2 ttm180 -57.87 -60.26 3.98 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 124.248 0.968 . . . . 0.0 110.273 -175.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 29.4 t 153.78 91.7 0.0 OUTLIER 'General case' 0 C--N 1.36 1.029 0 C-N-CA 125.501 1.52 . . . . 0.0 109.354 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.48 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 40.1 ptt180 -109.55 -24.57 10.91 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.972 174.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 86' ' ' ARG . 3.8 mm? . . . . . 0 C--N 1.314 -0.957 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.608 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 25.0 m -154.04 159.27 41.49 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 95.8 mmm -115.88 94.44 4.67 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 5.1 p -88.91 15.88 7.81 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.192 -176.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -135.58 143.02 45.42 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -83.91 88.39 7.13 Favored 'General case' 0 CA--C 1.481 -1.689 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.43 84.16 0.01 OUTLIER Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 113.329 -1.76 . . . . 0.0 115.504 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -121.24 -17.74 7.59 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.762 0.792 . . . . 0.0 109.47 169.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -64.84 -49.47 70.44 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.562 -176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 30.2 m -55.62 -45.93 77.45 Favored 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 114.001 -1.454 . . . . 0.0 110.617 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.93 -51.98 16.4 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.535 -173.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -67.52 -36.73 81.6 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.517 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.69 -46.36 82.71 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.006 0.432 . . . . 0.0 110.112 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.83 -44.78 96.48 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.261 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.689 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 21.9 mt -55.09 -67.29 0.28 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.856 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 13.7 t -58.0 -28.91 64.85 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.8 p -73.97 -52.6 12.31 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.809 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.529 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 53.6 m-20 -76.21 -43.74 40.88 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 119.154 -1.018 . . . . 0.0 112.319 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.411 ' HB3' HD22 ' A' ' 14' ' ' LEU . 20.1 m -56.5 -54.02 50.66 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.547 0.689 . . . . 0.0 111.705 -173.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.54 -11.13 60.13 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.451 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 32.1 t -71.26 -24.73 62.22 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . 0.406 ' CE1' ' HA2' ' B' ' 127' ' ' GLY . 31.8 m-70 -73.43 -22.86 60.11 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.882 0.849 . . . . 0.0 109.667 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.2 t -91.82 12.23 22.16 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -127.15 -53.12 1.4 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.48 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 157.0 101.75 0.18 Allowed Glycine 0 N--CA 1.434 -1.446 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.77 178.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 141.08 142.01 4.07 Favored Glycine 0 N--CA 1.436 -1.341 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.351 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . 0.406 ' HA2' ' CE1' ' B' ' 122' ' ' HIS . . . -96.03 82.67 0.81 Allowed Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.7 m -63.63 111.94 2.6 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 123.673 0.789 . . . . 0.0 112.209 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -101.26 -123.92 5.28 Favored Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.17 159.69 10.6 Favored Glycine 0 C--N 1.305 -1.147 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -105.97 -179.17 23.52 Favored Glycine 0 C--N 1.307 -1.061 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -130.81 -49.2 1.04 Allowed 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.384 -0.927 . . . . 0.0 110.954 -176.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 115.95 92.35 1.76 Allowed Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -83.69 133.56 11.98 Favored Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -158.72 35.42 0.5 Allowed Glycine 0 N--CA 1.436 -1.365 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.0 m 59.11 67.38 0.92 Allowed 'General case' 0 C--O 1.245 0.818 0 CA-C-O 122.751 1.262 . . . . 0.0 112.482 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -104.5 -26.63 12.31 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.543 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -90.35 -43.24 10.46 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -169.064 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 62.2 m -52.26 -38.43 58.19 Favored 'General case' 0 CA--C 1.558 1.261 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -173.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . 0.426 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 5.3 p-10 -96.14 -11.95 25.46 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 121.607 -0.683 . . . . 0.0 111.025 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.482 ' SD ' ' HE2' ' A' ' 82' ' ' LYS . 11.9 tpt -81.33 -22.43 38.48 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.528 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -50.89 -27.13 6.83 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.0 m -58.78 -53.53 57.38 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-O 121.053 0.454 . . . . 0.0 110.681 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.404 HD11 ' HE3' ' B' ' 141' ' ' MET 0.25 2.7 pp -73.92 -24.17 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 121.164 0.506 . . . . 0.0 111.147 178.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.56 ' CG2' HD12 ' A' ' 26' ' ' ILE . 13.8 mm -65.17 -42.52 94.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.081 172.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.479 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 49.0 ttp180 -62.08 -37.67 85.91 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.674 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.2 m -56.55 -53.89 52.28 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 123.662 0.601 . . . . 0.0 110.224 172.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.2 -41.54 90.05 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' B' ' 146' ' ' ARG 0.268 3.4 pp -68.29 -31.23 70.53 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.57 -0.707 . . . . 0.0 111.764 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.5 ttt -77.05 -54.93 5.92 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.454 177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -105.24 120.74 42.29 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.101 0.477 . . . . 0.0 111.95 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.025 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.853 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.787 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.6 m -125.56 148.94 30.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.69 116.41 24.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 121.734 0.778 . . . . 0.0 112.02 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 12.3 ptpt -154.17 112.21 3.53 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.75 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.26 -8.17 22.89 Favored Glycine 0 N--CA 1.47 0.912 0 N-CA-C 116.424 1.33 . . . . 0.0 116.424 -170.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -79.9 -3.0 46.18 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 121.543 -0.975 . . . . 0.0 110.027 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.524 ' HB2' ' O ' ' A' ' 4' ' ' LYS . 8.8 t-80 -60.84 -32.34 71.74 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 125.936 1.695 . . . . 0.0 108.809 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -81.71 -4.26 55.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.147 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -109.23 -15.67 14.24 Favored 'General case' 0 CA--C 1.499 -1.002 0 CA-C-O 121.3 0.571 . . . . 0.0 111.627 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.422 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 7.5 p -101.98 109.8 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.179 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -81.22 150.5 28.58 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.256 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.21 -39.96 73.29 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 123.542 0.526 . . . . 0.0 110.146 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -64.07 -33.58 76.08 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.859 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -73.72 -48.08 34.64 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -174.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.466 ' O ' HG23 ' A' ' 19' ' ' VAL . 8.3 ptm180 -69.8 -41.49 74.97 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.276 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.7 t -70.18 -23.09 62.91 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.469 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 18.8 t60 -71.07 -42.37 69.5 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.459 HD23 HD21 ' A' ' 68' ' ' LEU . 1.9 mp -62.06 -38.25 88.07 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.463 176.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 15' ' ' ARG . 93.8 t -60.31 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.19 0.596 . . . . 0.0 109.505 172.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -52.96 -46.61 68.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.699 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.469 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 61.5 mttm -65.66 -39.47 91.4 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.7 mt -55.31 -45.5 76.32 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.358 0.411 . . . . 0.0 110.142 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.418 ' CG1' ' HE2' ' A' ' 40' ' ' MET . 30.9 t -60.49 -55.01 27.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 O-C-N 123.852 0.72 . . . . 0.0 111.187 175.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.04 -26.74 68.42 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -176.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.492 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.52 -45.84 15.35 Favored 'General case' 0 C--O 1.206 -1.228 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.576 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.505 HD13 ' CG2' ' B' ' 145' ' ' ILE . 4.2 tt -70.43 -28.35 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 121.952 0.882 . . . . 0.0 109.639 -177.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.1 86.5 51.22 Favored Pre-proline 0 N--CA 1.394 -3.25 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.445 -177.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.76 98.49 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.399 0 C-N-CA 122.244 1.963 . . . . 0.0 107.413 168.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 t -73.61 142.86 81.32 Favored Pre-proline 0 N--CA 1.408 -2.546 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.653 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.53 -24.74 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.385 2.056 . . . . 0.0 111.435 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -155.7 142.61 13.55 Favored Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -174.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.31 -24.68 61.25 Favored 'Trans proline' 0 C--N 1.321 -0.873 0 C-N-CA 122.73 2.287 . . . . 0.0 114.659 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.33 -8.11 58.83 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.248 -0.908 . . . . 0.0 111.936 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.2 -11.39 59.82 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.733 0.777 . . . . 0.0 109.185 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.7 mt -87.73 3.49 47.83 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.262 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.0 19.22 4.1 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 122.534 1.159 . . . . 0.0 109.169 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.673 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.0 t70 -83.34 177.77 8.35 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.092 -177.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.673 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.29 -33.26 71.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.123 0.487 . . . . 0.0 110.158 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -69.21 -20.33 63.98 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 122.112 0.958 . . . . 0.0 109.935 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.595 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -62.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.696 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.449 ' O ' ' HB1' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -62.39 -32.77 73.64 Favored 'General case' 0 C--O 1.174 -2.895 0 C-N-CA 118.144 -1.422 . . . . 0.0 110.785 -178.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.21 -47.98 66.43 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.591 0.557 . . . . 0.0 110.872 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.6 -44.64 77.62 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.863 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.595 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.7 p -73.46 -32.72 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.027 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -61.16 -45.45 94.58 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.629 0.728 . . . . 0.0 109.094 176.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.466 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -58.56 -47.09 85.38 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.496 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.01 98.17 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.801 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 94.1 mttt -63.24 -44.0 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.106 0.563 . . . . 0.0 111.315 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.5 pttp -68.46 -39.42 81.43 Favored 'General case' 0 C--O 1.25 1.095 0 CA-C-O 121.307 0.575 . . . . 0.0 110.605 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.42 -50.83 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.687 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -56.71 -48.51 77.55 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.142 0.977 . . . . 0.0 109.668 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.97 -40.24 93.01 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.38 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -61.52 -55.25 33.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-O 120.336 0.112 . . . . 0.0 110.879 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.428 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -64.75 -28.61 69.7 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.735 0.642 . . . . 0.0 112.735 179.743 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -64.53 -51.68 61.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -70.64 -24.42 62.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.62 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 64.9 m -82.29 -33.61 29.0 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.5 164.75 18.61 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.326 0.584 . . . . 0.0 112.422 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -113.15 13.6 19.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.402 0.62 . . . . 0.0 111.351 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.6 p -163.78 153.9 15.16 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 171.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.422 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -70.36 -33.67 71.72 Favored 'General case' 0 C--O 1.188 -2.177 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.312 -178.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.97 -35.82 82.41 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -67.07 -46.91 72.87 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.286 175.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.63 -44.82 95.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.773 0.671 . . . . 0.0 109.609 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -49.33 75.61 Favored 'General case' 0 C--O 1.208 -1.125 0 C-N-CA 125.077 1.351 . . . . 0.0 109.492 175.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -63.5 -49.61 72.87 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.62 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 pp -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.628 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.459 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.06 -36.89 58.82 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 177.444 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -63.44 -36.56 84.14 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.02 -47.29 83.71 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.633 0.73 . . . . 0.0 110.954 174.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.41 ' HZ3' HG12 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -63.65 -44.38 93.98 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.5 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.48 HG23 ' HA ' ' A' ' 69' ' ' ALA . 4.9 tt -69.58 -35.77 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.374 -177.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.537 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.46 -54.25 43.44 Favored 'General case' 0 C--O 1.26 1.625 0 C-N-CA 124.525 1.13 . . . . 0.0 110.936 175.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.15 -32.4 73.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.374 -176.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.41 HG12 ' HZ3' ' A' ' 71' ' ' LYS . 1.4 mp -65.24 -45.71 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.821 177.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.492 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 36.4 mt-30 -59.28 -53.83 53.75 Favored 'General case' 0 CA--C 1.481 -1.705 0 O-C-N 123.798 0.686 . . . . 0.0 111.364 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.648 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -67.7 -35.22 78.41 Favored 'General case' 0 N--CA 1.415 -2.21 0 C-N-CA 119.192 -1.003 . . . . 0.0 112.524 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 12.0 tp10 -59.98 -48.86 79.96 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.629 ' HB2' ' OE1' ' B' ' 138' ' ' GLU . 4.6 pp -67.11 -43.77 81.64 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.6 -49.85 69.49 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 123.28 0.362 . . . . 0.0 111.356 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -68.36 -31.74 71.33 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HZ3' ' HB2' ' A' ' 83' ' ' ARG . 1.6 pptp? -72.92 -34.28 66.5 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.107 -0.637 . . . . 0.0 111.45 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HB2' ' HZ3' ' A' ' 82' ' ' LYS . 12.2 tpt180 -76.27 -36.94 58.18 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 119.751 -0.78 . . . . 0.0 109.076 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -59.52 -43.44 93.43 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.6 t 76.77 85.41 0.08 Allowed 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.443 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -99.69 -11.36 20.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.271 176.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 C--O 1.245 0.825 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.469 -175.304 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.758 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.1 m -90.63 88.55 7.16 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-O 121.196 0.522 . . . . 0.0 111.59 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -88.07 72.13 9.22 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 170.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.7 t -80.05 94.7 6.0 Favored 'General case' 0 N--CA 1.403 -2.78 0 CA-C-N 112.848 -1.978 . . . . 0.0 111.909 -169.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -102.15 -8.4 21.4 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.228 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -148.98 151.81 35.22 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.04 -32.75 7.16 Favored Glycine 0 CA--C 1.499 -0.965 0 N-CA-C 110.28 -1.128 . . . . 0.0 110.28 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.601 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 40.9 p-10 -100.07 -0.41 39.13 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.277 -0.961 . . . . 0.0 109.844 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -63.62 -27.91 69.56 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.248 -174.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.608 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 5.3 t -66.25 -44.3 84.08 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.037 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.54 -42.82 67.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.973 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 7.3 mm100 -62.57 -35.31 79.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -66.52 -44.47 82.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.056 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' B' ' 110' ' ' THR . 71.8 mt -60.5 -42.73 96.94 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.041 0.448 . . . . 0.0 109.795 177.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.63 -59.02 5.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.686 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 19.4 m -60.93 -44.14 97.64 Favored 'General case' 0 C--O 1.247 0.929 0 O-C-N 123.858 0.724 . . . . 0.0 111.347 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' B' ' 121' ' ' SER . 44.7 m -62.9 -46.66 86.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.537 -174.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.415 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 17.2 m-20 -76.22 -41.36 49.55 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 118.556 -1.258 . . . . 0.0 111.835 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' B' ' 123' ' ' SER . 53.7 p -69.2 -54.9 12.43 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -173.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.75 -49.94 9.22 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' B' ' 117' ' ' SER . 14.6 m -73.73 -38.42 64.78 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -175.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -102.32 -30.1 11.27 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' B' ' 119' ' ' SER . 22.7 m 73.03 -51.84 0.71 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.308 1.443 . . . . 0.0 112.777 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -89.19 -40.34 12.94 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 89.53 175.05 46.02 Favored Glycine 0 CA--C 1.499 -0.923 0 CA-C-N 115.41 -0.814 . . . . 0.0 113.294 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 89.03 -78.83 1.65 Allowed Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.409 175.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 70.34 -103.88 1.25 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.9 m -100.56 91.76 4.81 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 172.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -129.74 -96.46 0.79 Allowed Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 86.63 -49.88 4.11 Favored Glycine 0 C--N 1.301 -1.4 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 152.15 155.24 6.95 Favored Glycine 0 N--CA 1.429 -1.828 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.2 t -135.11 5.28 3.28 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.8 0.809 . . . . 0.0 109.425 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.86 -142.48 4.52 Favored Glycine 0 N--CA 1.435 -1.384 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.598 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -164.32 156.38 28.25 Favored Glycine 0 N--CA 1.423 -2.192 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -72.77 -24.97 75.12 Favored Glycine 0 CA--C 1.499 -0.927 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 3.5 p -63.31 -37.54 87.66 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 123.634 0.774 . . . . 0.0 110.721 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.7 -49.07 77.94 Favored 'General case' 0 C--O 1.254 1.313 0 CA-C-O 121.796 0.808 . . . . 0.0 109.661 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.629 ' OE1' ' HB2' ' A' ' 79' ' ' LEU 0.384 28.4 mm-40 -83.28 -9.53 59.06 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -172.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . 0.617 ' HA ' ' OE2' ' B' ' 142' ' ' GLU . 45.5 t -58.28 -22.87 54.36 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-O 121.762 0.791 . . . . 0.0 109.734 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.43 -32.86 54.88 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.304 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.525 ' SD ' HD12 ' B' ' 144' ' ' ILE . 10.8 tpt -80.72 -23.02 39.77 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 123.894 0.877 . . . . 0.0 108.773 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.617 ' OE2' ' HA ' ' B' ' 139' ' ' CYS . 39.2 mt-10 -47.53 -26.17 1.34 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.2 m -55.94 -59.26 5.15 Favored 'General case' 0 C--O 1.259 1.599 0 CA-C-O 121.701 0.762 . . . . 0.0 111.138 174.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.525 HD12 ' SD ' ' B' ' 141' ' ' MET 0.291 2.6 pp -72.52 -23.59 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 O-C-N 121.356 -0.84 . . . . 0.0 111.674 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.555 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 29.2 mm -67.39 -38.55 80.99 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.801 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.675 172.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.436 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 15.2 tpp180 -59.14 -43.96 92.04 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.2 m -58.37 -48.16 81.51 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.598 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -72.07 -37.35 69.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.436 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.9 pp -68.34 -24.58 64.83 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.332 -0.855 . . . . 0.0 110.27 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.3 tpt -81.97 -61.45 1.91 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 173.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -120.62 108.46 14.06 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.958 0.409 . . . . 0.0 111.588 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.375 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 176.992 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.484 -1.903 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.06 121.6 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.68 0.752 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.418 ' H ' ' HD2' ' A' ' 3' ' ' ARG 0.272 0.2 OUTLIER -77.97 68.03 3.94 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.811 1.291 . . . . 0.0 112.906 -178.914 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 51.0 mtmt -141.92 90.13 2.24 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 105.289 -2.115 . . . . 0.0 105.289 176.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -14.58 40.2 Favored Glycine 0 C--N 1.319 -0.415 0 N-CA-C 114.404 0.521 . . . . 0.0 114.404 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.574 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 65.4 p-90 -63.91 -19.89 65.44 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.403 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 5.3 p80 -61.94 -20.72 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.277 0.56 . . . . 0.0 111.393 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -82.5 -10.78 58.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -108.58 8.31 27.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.867 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.3 p -129.66 118.54 45.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 CA-C-O 121.317 0.579 . . . . 0.0 110.043 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -85.8 153.1 22.51 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.287 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -38.29 70.09 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-O 121.016 0.436 . . . . 0.0 110.765 177.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.479 ' CB ' ' HA ' ' B' ' 124' ' ' ASP . 7.2 m-20 -69.73 -27.72 65.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.38 -51.15 18.39 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' O ' HG22 ' A' ' 19' ' ' VAL . 6.1 ptm180 -64.78 -38.28 90.45 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.837 -179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -70.01 -26.41 64.05 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -73.53 -36.17 65.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.441 HD21 HD23 ' A' ' 68' ' ' LEU . 2.4 mp -63.43 -39.13 93.65 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.467 HG22 ' O ' ' A' ' 15' ' ' ARG . 70.2 t -59.19 -49.93 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.405 0.682 . . . . 0.0 109.31 172.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -52.31 -46.33 65.95 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 124.569 1.148 . . . . 0.0 110.814 176.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.402 ' CE ' ' HB2' ' B' ' 118' ' ' ASP . 55.0 mttm -64.15 -42.36 96.81 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.277 177.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.4 mt -54.63 -46.06 73.83 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -57.38 -49.97 78.43 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.758 175.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -68.03 -24.15 65.07 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.425 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -80.37 -46.34 16.21 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.003 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.537 HD12 ' CG2' ' B' ' 145' ' ' ILE . 3.9 tt -70.89 -29.33 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.958 0.885 . . . . 0.0 110.003 -178.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -127.14 90.74 48.41 Favored Pre-proline 0 N--CA 1.401 -2.901 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.025 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -55.64 127.31 25.63 Favored 'Trans proline' 0 N--CA 1.447 -1.244 0 C-N-CA 122.398 2.065 . . . . 0.0 108.22 170.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 p -70.46 120.59 79.61 Favored Pre-proline 0 C--N 1.283 -2.308 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -87.17 -26.5 0.82 Allowed 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.067 1.178 . . . . 0.0 109.046 167.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -154.13 140.61 12.9 Favored Pre-proline 0 CA--C 1.495 -1.149 0 C-N-CA 125.471 1.508 . . . . 0.0 107.225 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -67.42 -19.48 49.24 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.276 1.318 . . . . 0.0 110.586 171.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.61 -6.81 59.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -13.99 59.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 122.333 1.063 . . . . 0.0 108.43 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.0 4.49 16.82 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.102 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.41 22.92 3.73 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.16 0.505 . . . . 0.0 110.987 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.432 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 10.2 t70 -87.56 -176.99 5.78 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -71.3 -17.44 62.46 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 119.823 1.192 . . . . 0.0 110.418 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 21.9 ttm180 -70.97 -20.31 62.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.404 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.668 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.8 tpp -66.94 -42.89 84.52 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.07 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.8 pt-20 -59.86 -29.53 68.36 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.062 -0.655 . . . . 0.0 109.869 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.3 t30 -73.61 -51.53 16.52 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 124.571 1.148 . . . . 0.0 110.346 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.22 -44.17 80.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.749 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.668 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -72.62 -33.33 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.893 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.071 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -58.57 -45.26 89.38 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.0 t80 -60.41 -50.49 73.37 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.696 174.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.88 -39.66 90.07 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 120.714 0.292 . . . . 0.0 110.951 -176.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.2 mttt -65.22 -45.24 85.5 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 123.373 0.669 . . . . 0.0 111.552 177.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.9 pttp -65.72 -39.25 90.98 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.152 0.501 . . . . 0.0 109.726 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' A' ' 54' ' ' MET . 53.5 t -67.09 -52.39 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.807 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -55.59 -50.11 70.97 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 124.122 0.889 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.06 -40.7 97.42 Favored Glycine 0 CA--C 1.507 -0.461 0 O-C-N 123.607 0.567 . . . . 0.0 112.642 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.39 -54.26 48.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.031 0.443 . . . . 0.0 110.187 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.499 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.6 ptp -70.26 -30.51 67.56 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.28 -40.97 97.05 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.57 ' HA ' ' NZ ' ' A' ' 4' ' ' LYS . 17.0 mt-10 -78.74 -24.97 44.53 Favored 'General case' 0 C--N 1.313 -1.003 0 O-C-N 121.149 -0.969 . . . . 0.0 112.067 177.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.469 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 50.0 m -86.67 -18.8 30.37 Favored 'General case' 0 C--N 1.277 -2.561 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -175.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.25 160.14 14.82 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -98.59 -2.66 38.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.689 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.542 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 81.2 p -158.64 161.67 37.2 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -29.74 66.36 Favored 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.915 177.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.77 -41.57 83.08 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.544 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 7.6 tp10 -62.97 -49.53 74.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 176.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -43.64 98.25 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.782 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.502 ' HH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -54.21 -48.88 70.55 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 172.625 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.0 -55.8 16.87 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.787 -172.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 2.1 pp -65.62 -30.16 70.84 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.499 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -75.92 -39.26 56.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 177.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -61.66 -32.94 73.14 Favored 'General case' 0 C--N 1.351 0.639 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.9 mm-40 -65.56 -47.08 77.05 Favored 'General case' 0 C--O 1.249 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 111.705 174.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.09 -36.3 66.78 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.039 -1.064 . . . . 0.0 112.048 -177.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.608 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.8 tt -65.35 -37.8 80.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.785 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.49 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 12.5 t80 -54.25 -54.02 45.77 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 124.599 1.16 . . . . 0.0 111.907 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.521 ' HB3' ' HZ2' ' A' ' 74' ' ' LYS . 0.6 OUTLIER -65.41 -32.94 74.83 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.848 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.6 -41.02 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.608 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 51.5 mt-30 -64.27 -48.26 76.4 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.537 0.684 . . . . 0.0 110.622 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.84 -26.55 59.78 Favored 'General case' 0 N--CA 1.398 -3.057 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.6 tt0 -61.51 -48.63 80.17 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.727 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -66.51 -38.2 86.69 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.926 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -64.11 -47.85 78.4 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -63.48 -41.06 98.58 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 118.268 0.485 . . . . 0.0 111.543 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -71.46 -34.38 70.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.434 -178.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -77.22 -39.25 49.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.837 -177.245 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -98.23 -57.42 2.21 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -170.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.5 p -150.97 95.19 2.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -170.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -160.27 -34.56 0.05 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 168.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.5 mp . . . . . 0 C--O 1.249 1.051 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.681 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.096 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m 57.76 82.3 0.13 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 123.673 0.789 . . . . 0.0 110.563 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 80.2 mtp 59.98 68.92 0.74 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.64 0.776 . . . . 0.0 108.974 -175.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.1 m -70.01 161.56 29.82 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.446 -176.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -80.48 90.83 5.68 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 56.1 p90 -72.02 -176.07 1.64 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.732 -175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.74 -50.85 0.86 Allowed Glycine 0 N--CA 1.417 -2.581 0 N-CA-C 109.246 -1.542 . . . . 0.0 109.246 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 34.1 p-10 -75.93 -14.09 60.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 113.639 -1.28 . . . . 0.0 111.767 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -68.37 -42.15 79.59 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.907 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.641 ' HA ' ' OD2' ' B' ' 113' ' ' ASP . 7.6 t -71.33 -31.27 67.2 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.728 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.79 -35.53 81.38 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.256 175.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 29.7 mm-40 -64.55 -40.16 95.07 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . 0.641 ' OD2' ' HA ' ' B' ' 110' ' ' THR . 38.2 m-20 -54.17 -48.51 70.85 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.39 0.431 . . . . 0.0 110.417 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.78 -46.12 88.26 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.802 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -57.71 -63.45 1.24 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.835 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.502 ' HB ' ' HH ' ' A' ' 65' ' ' TYR . 14.9 t -60.17 -39.29 85.9 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.7 t -71.74 -47.54 53.1 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.074 -174.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.402 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 15.9 m-20 -71.73 -54.2 11.05 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.72 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 5.5 m -60.47 -44.53 95.8 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -171.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.03 -19.96 39.33 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -176.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.9 t -76.29 -40.79 50.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -64.45 -50.75 66.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.427 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 64.3 p 56.71 -90.98 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.966 1.707 . . . . 0.0 112.55 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.479 ' HA ' ' CB ' ' A' ' 13' ' ' ASP . 6.6 p-10 -142.56 20.1 2.03 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.71 0.767 . . . . 0.0 110.314 177.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -132.79 -123.63 2.45 Favored Glycine 0 N--CA 1.432 -1.587 0 N-CA-C 109.342 -1.503 . . . . 0.0 109.342 177.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 97.52 131.87 7.24 Favored Glycine 0 N--CA 1.434 -1.437 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.352 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -113.82 12.14 22.75 Favored Glycine 0 N--CA 1.438 -1.225 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 175.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.1 m -64.87 -46.41 81.91 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 122.824 0.449 . . . . 0.0 109.792 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 71.93 -111.82 3.79 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.503 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.96 149.95 21.82 Favored Glycine 0 N--CA 1.42 -2.367 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 178.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 169.51 108.65 0.21 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 34.5 t -174.45 145.84 1.0 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.23 176.3 22.8 Favored Glycine 0 N--CA 1.437 -1.283 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 162.22 -64.25 0.26 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.701 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 141.83 -170.37 24.88 Favored Glycine 0 N--CA 1.44 -1.038 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.682 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 36.5 m -93.74 90.71 6.68 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-O 121.723 0.773 . . . . 0.0 111.503 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.32 -15.6 18.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.633 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.41 ' CD ' ' H ' ' B' ' 139' ' ' CYS . 0.0 OUTLIER -70.12 -62.6 1.32 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.203 0.445 . . . . 0.0 112.203 -177.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . 0.41 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 45.7 m 23.57 -83.23 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 128.316 2.646 . . . . 0.0 116.146 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -39.88 85.26 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.847 1.259 . . . . 0.0 110.233 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.727 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 21.3 ttt -66.47 -23.68 66.31 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.987 -174.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.515 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 42.9 mt-10 -57.71 -26.74 62.19 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 26.0 m -66.88 -49.11 66.68 Favored 'General case' 0 C--O 1.26 1.614 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.975 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.9 pp -71.12 -28.06 31.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.834 0.826 . . . . 0.0 110.183 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.537 ' CG2' HD12 ' A' ' 26' ' ' ILE . 12.1 mm -67.79 -44.48 85.58 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.252 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.138 174.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -60.62 -39.1 86.97 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 22.9 t -61.24 -50.63 72.28 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.66 -53.16 61.24 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.454 1.101 . . . . 0.0 112.588 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.494 HD11 ' N ' ' B' ' 150' ' ' MET . 3.7 pp -72.71 -31.18 64.8 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -173.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.494 ' N ' HD11 ' B' ' 149' ' ' LEU . 49.5 tpp -75.91 -43.41 45.31 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.454 -174.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -151.4 131.9 13.84 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.288 0.566 . . . . 0.0 110.882 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.518 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 179.808 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.247 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 69.6 t 78.96 120.78 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 C-N-CA 124.395 1.078 . . . . 0.0 110.058 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -81.05 117.3 21.53 Favored 'General case' 0 N--CA 1.413 -2.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.598 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -127.81 114.87 17.79 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.91 -29.98 8.77 Favored Glycine 0 N--CA 1.477 1.37 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.519 ' CD2' ' HA ' ' A' ' 60' ' ' SER . 62.4 p-90 -63.98 -17.84 63.68 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.545 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 20.7 p80 -69.35 -13.47 62.39 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.876 -177.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -89.61 -2.98 58.48 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.485 0.659 . . . . 0.0 109.788 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -95.62 -13.17 24.56 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.528 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.597 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -104.77 110.77 31.79 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.722 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.8 m -73.3 149.61 42.55 Favored 'General case' 0 C--N 1.279 -2.459 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -38.48 72.08 Favored 'General case' 0 C--O 1.209 -1.049 0 O-C-N 123.556 0.535 . . . . 0.0 109.654 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.89 -29.02 68.02 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.64 -52.97 9.33 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.443 ' O ' HG22 ' A' ' 19' ' ' VAL . 5.2 ptm180 -58.66 -41.79 86.92 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.178 176.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.5 t -69.21 -25.4 64.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.434 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 15.2 t60 -67.98 -38.95 83.31 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -37.72 82.38 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.811 177.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 15' ' ' ARG . 98.2 t -57.04 -47.87 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-O 121.548 0.69 . . . . 0.0 109.384 174.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.434 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.2 t-80 -53.93 -50.66 65.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.503 176.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.486 ' CD ' HD23 ' B' ' 115' ' ' LEU . 54.8 mttm -64.6 -37.11 86.45 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.6 mt -55.58 -43.92 76.4 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.342 0.401 . . . . 0.0 109.941 176.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG23 ' HB3' ' A' ' 43' ' ' LEU . 2.3 t -60.08 -53.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 123.684 0.615 . . . . 0.0 111.905 175.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -65.48 -27.53 68.56 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.817 0.341 . . . . 0.0 111.624 -176.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.445 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -81.33 -43.2 19.41 Favored 'General case' 0 N--CA 1.424 -1.765 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.947 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.526 HD13 ' CG2' ' B' ' 145' ' ' ILE . 1.8 tt -70.22 -39.93 77.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.405 0 CA-C-O 121.606 0.717 . . . . 0.0 109.66 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.428 ' CD2' ' HD3' ' A' ' 39' ' ' ARG . 4.4 m-85 -125.66 102.29 29.28 Favored Pre-proline 0 N--CA 1.401 -2.887 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.759 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.86 140.89 22.59 Favored 'Trans proline' 0 N--CA 1.438 -1.766 0 C-N-CA 123.294 2.663 . . . . 0.0 111.347 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.45 109.92 63.49 Favored Pre-proline 0 N--CA 1.382 -3.847 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.481 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.07 -26.92 4.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 121.92 1.747 . . . . 0.0 110.622 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -156.42 143.23 13.46 Favored Pre-proline 0 N--CA 1.433 -1.322 0 N-CA-C 106.22 -1.77 . . . . 0.0 106.22 -176.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.91 -21.82 42.87 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.612 2.208 . . . . 0.0 113.761 176.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -18.02 63.64 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.561 -0.712 . . . . 0.0 112.306 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.3 -14.76 63.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.652 0.739 . . . . 0.0 110.173 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.493 ' O ' ' HG2' ' A' ' 40' ' ' MET . 13.2 mt -91.32 1.78 56.86 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.569 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -133.16 14.91 4.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 122.076 0.941 . . . . 0.0 109.677 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.624 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 21.3 t70 -79.38 174.29 11.72 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.302 179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.624 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -25.89 63.01 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.543 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.428 ' HD3' ' CD2' ' A' ' 27' ' ' PHE . 23.9 ttm180 -61.03 -27.87 68.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.624 175.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.515 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 11.1 tpp -62.75 -42.49 99.7 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.773 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.54 -33.31 72.49 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 119.589 -0.844 . . . . 0.0 109.689 -176.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -71.97 -45.54 60.63 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.454 1.101 . . . . 0.0 110.479 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.425 ' HB3' HG23 ' A' ' 23' ' ' VAL . 95.5 mt -67.31 -45.32 76.81 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.327 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.502 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -72.83 -32.19 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 C-N-CA 120.534 -0.467 . . . . 0.0 110.239 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.89 -43.67 98.37 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.544 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.2 t80 -61.47 -51.45 68.61 Favored 'General case' 0 C--O 1.208 -1.085 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.975 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.24 87.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.629 0.252 . . . . 0.0 111.334 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -64.8 -42.64 94.88 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.4 pttp -70.5 -35.59 73.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.272 0.558 . . . . 0.0 110.208 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.42 HG21 ' O ' ' A' ' 46' ' ' TYR . 54.6 t -65.32 -49.68 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.162 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -55.43 -51.9 65.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.271 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.34 -38.85 91.66 Favored Glycine 0 C--N 1.333 0.393 0 O-C-N 123.642 0.589 . . . . 0.0 112.975 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.14 -54.12 45.68 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.254 0.55 . . . . 0.0 111.054 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.425 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.2 ptp -69.49 -27.82 65.53 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.545 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 57.7 t80 -62.47 -54.14 44.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.92 -17.81 60.5 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.184 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.0 t -79.72 -19.64 48.36 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 120.741 0.305 . . . . 0.0 110.96 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.48 165.25 12.09 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -175.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.43 6.12 37.46 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.284 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.519 ' HA ' ' CD2' ' A' ' 6' ' ' TRP . 7.2 t -173.59 162.66 4.21 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.597 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.95 -30.37 71.35 Favored 'General case' 0 C--O 1.168 -3.197 0 O-C-N 123.804 0.69 . . . . 0.0 110.77 178.18 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.12 -47.39 78.21 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.891 0.853 . . . . 0.0 109.543 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -71.6 -43.8 65.58 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.494 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -40.12 94.93 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.623 ' CE1' HD13 ' B' ' 115' ' ' LEU . 5.1 t80 -60.6 -47.05 87.93 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.207 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.618 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 40.5 t-80 -63.35 -53.76 47.5 Favored 'General case' 0 C--O 1.205 -1.253 0 O-C-N 123.716 0.635 . . . . 0.0 111.524 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.87 -30.47 69.84 Favored 'General case' 0 C--O 1.256 1.43 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.167 -174.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.425 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.23 -44.05 63.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 174.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -52.95 -33.0 48.91 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.394 0.678 . . . . 0.0 111.717 173.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 31.3 mt-10 -73.38 -44.63 58.17 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.549 0.214 . . . . 0.0 110.845 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' HD11 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.12 -37.74 78.49 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 118.687 -1.205 . . . . 0.0 110.509 -179.432 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.616 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -36.77 77.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.548 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.8 -54.29 36.19 Favored 'General case' 0 C--O 1.258 1.527 0 C-N-CA 124.505 1.122 . . . . 0.0 110.379 174.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.7 ptpt -69.36 -31.82 70.49 Favored 'General case' 0 C--O 1.204 -1.334 0 O-C-N 123.8 0.688 . . . . 0.0 110.771 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.47 ' HA ' ' HE3' ' B' ' 141' ' ' MET . 1.3 mp -63.15 -46.93 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 O-C-N 123.389 0.431 . . . . 0.0 109.955 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 52.5 mt-30 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.699 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.588 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -74.07 -28.22 61.28 Favored 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.421 -176.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -62.49 -52.79 62.1 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.651 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -62.03 -44.54 96.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.927 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.3 OUTLIER -62.63 -53.63 51.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.698 -178.099 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.3 pt-20 -76.35 -34.77 58.95 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -28.71 60.89 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.029 -178.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -70.99 -44.27 66.31 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -70.54 -45.69 65.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.449 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 31.6 t 79.5 85.14 0.06 Allowed 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 125.324 1.45 . . . . 0.0 111.103 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -110.49 1.23 18.11 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.084 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--N 1.309 -1.159 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.976 -177.262 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.667 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 24.6 m 67.33 -74.71 0.07 Allowed 'General case' 0 C--O 1.245 0.839 0 C-N-CA 125.063 1.345 . . . . 0.0 111.238 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 28.0 ttt -146.72 78.96 1.52 Allowed 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 121.725 0.774 . . . . 0.0 110.745 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 50.8 m -129.39 -1.55 5.0 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.961 170.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 30.3 m80 66.14 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.986 1.714 . . . . 0.0 109.93 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.401 ' HB2' ' OE1' ' B' ' 109' ' ' GLN . 72.8 m-85 -119.61 -58.86 1.87 Allowed 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 172.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.2 -44.12 3.29 Favored Glycine 0 CA--C 1.495 -1.173 0 CA-C-N 114.539 -1.21 . . . . 0.0 113.803 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.56 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 32.8 p-10 -77.05 -11.1 59.76 Favored 'General case' 0 C--N 1.278 -2.542 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -170.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.401 ' OE1' ' HB2' ' B' ' 106' ' ' TYR . 5.1 pm0 -62.04 -35.02 77.34 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 123.461 0.476 . . . . 0.0 110.995 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 18.1 m -65.46 -40.97 93.85 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-O 121.244 0.545 . . . . 0.0 109.949 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.54 -40.45 85.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.866 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 25.0 mt-30 -64.52 -39.32 93.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.575 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.92 -50.96 68.79 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.647 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -42.23 90.94 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 123.166 0.291 . . . . 0.0 111.386 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.623 HD13 ' CE1' ' A' ' 65' ' ' TYR . 16.7 mt -51.44 -63.04 1.26 Allowed 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.643 0.59 . . . . 0.0 110.58 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 12.9 m -65.96 -28.48 68.93 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.495 -1.229 . . . . 0.0 112.298 -172.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.432 ' O ' ' HB3' ' B' ' 121' ' ' SER . 51.0 m -68.3 -40.66 81.66 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 120.631 -0.428 . . . . 0.0 109.957 176.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -76.15 -47.85 22.76 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.659 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' B' ' 123' ' ' SER . 60.7 p -73.73 -56.58 4.81 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.8 -54.54 4.82 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' B' ' 117' ' ' SER . 26.7 t -63.34 -43.11 98.68 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -174.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 64.5 m80 -101.66 -45.69 5.18 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.077 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' B' ' 119' ' ' SER . 67.9 m 74.99 8.6 4.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.611 1.165 . . . . 0.0 113.244 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -122.12 156.43 33.63 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -145.27 154.38 25.88 Favored Glycine 0 N--CA 1.429 -1.792 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.58 171.5 34.77 Favored Glycine 0 N--CA 1.423 -2.172 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . 0.457 ' HA3' ' CD1' ' A' ' 35' ' ' LEU . . . -94.21 111.54 4.18 Favored Glycine 0 N--CA 1.428 -1.852 0 C-N-CA 120.459 -0.876 . . . . 0.0 112.524 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.7 m -88.7 142.45 27.67 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -86.99 116.33 4.44 Favored Glycine 0 N--CA 1.436 -1.364 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -92.27 -166.5 39.36 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.862 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -119.12 32.04 5.25 Favored Glycine 0 C--N 1.309 -0.971 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 5.2 p -89.02 -69.28 0.72 Allowed 'General case' 0 N--CA 1.422 -1.868 0 C-N-CA 123.39 0.676 . . . . 0.0 111.146 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 116.16 160.99 12.48 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -107.84 134.06 12.0 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.15 32.96 7.52 Favored Glycine 0 N--CA 1.433 -1.549 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.098 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.2 p -149.95 -76.36 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 5.9 mp -65.4 -49.8 67.91 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 121.251 0.548 . . . . 0.0 111.12 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -71.42 -40.97 70.12 Favored 'General case' 0 C--O 1.191 -1.985 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.184 178.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 48.0 t -56.31 -39.95 73.58 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.485 0.714 . . . . 0.0 110.915 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -57.08 14.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.982 0.896 . . . . 0.0 111.103 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.651 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.8 ttt -77.02 -14.6 59.81 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.436 -173.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' B' ' 138' ' ' GLU . 13.4 tm-20 -56.55 -27.01 56.61 Favored 'General case' 0 C--O 1.2 -1.546 0 C-N-CA 124.096 0.958 . . . . 0.0 112.422 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 21.7 t -62.27 -49.95 73.65 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-N 117.97 0.35 . . . . 0.0 110.755 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.412 HD12 ' CG ' ' B' ' 141' ' ' MET 0.261 2.7 pp -70.29 -24.88 26.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.201 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.905 176.364 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.526 ' CG2' HD13 ' A' ' 26' ' ' ILE . 16.9 mm -63.13 -43.16 98.74 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.398 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 78.0 mtp180 -56.84 -45.1 82.59 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.304 0.641 . . . . 0.0 110.625 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 6.1 p -60.11 -36.64 77.91 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 119.542 -0.863 . . . . 0.0 113.255 176.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -76.11 -44.95 36.16 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.231 -0.988 . . . . 0.0 112.295 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.436 HD12 ' N ' ' B' ' 150' ' ' MET 0.262 3.1 pp -70.24 -33.55 71.78 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.211 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.436 ' N ' HD12 ' B' ' 149' ' ' LEU . 50.5 ttm -70.53 -40.73 73.27 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.242 0.544 . . . . 0.0 111.039 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -92.61 117.67 30.22 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.447 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.427 ' HB3' ' HZ1' ' A' ' 49' ' ' LYS . . . . . . . . 0 C--N 1.302 -1.476 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.759 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.2 m -127.57 148.46 32.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.06 93.09 4.1 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-O 122.287 1.041 . . . . 0.0 110.108 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -92.04 120.48 32.72 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.215 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.12 -18.92 36.44 Favored Glycine 0 N--CA 1.464 0.506 0 N-CA-C 116.156 1.223 . . . . 0.0 116.156 -168.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -76.01 -2.14 29.15 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 117.48 0.64 . . . . 0.0 112.087 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -62.53 -21.33 65.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.449 0.642 . . . . 0.0 110.793 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -86.2 -10.55 54.49 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.809 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -102.85 5.21 38.47 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.867 0.841 . . . . 0.0 110.09 -177.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.526 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.3 p -129.31 110.79 21.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.5 m -83.22 151.04 25.84 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.456 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.8 56.98 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.934 0.894 . . . . 0.0 111.33 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -69.73 -30.05 67.56 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -74.76 -47.69 29.71 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 -177.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.534 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.4 ptm180 -64.93 -41.25 95.7 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.621 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 t -69.6 -25.35 63.92 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.592 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 15.6 t60 -75.31 -36.86 61.04 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.888 177.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.455 HD21 HD21 ' A' ' 68' ' ' LEU . 1.4 mp -63.29 -37.63 87.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 173.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 15' ' ' ARG . 99.5 t -60.21 -45.78 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -55.77 -47.04 77.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.881 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -66.49 -39.21 88.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.78 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.401 ' O ' HG23 ' A' ' 26' ' ' ILE . 28.8 mt -53.47 -48.35 68.94 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 123.547 0.529 . . . . 0.0 109.799 173.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.401 ' CG1' ' HE2' ' A' ' 40' ' ' MET . 53.8 t -54.67 -48.64 71.72 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 O-C-N 124.237 0.96 . . . . 0.0 111.612 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -69.37 -24.19 63.85 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -44.55 16.24 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.503 175.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.665 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.09 -29.61 37.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.958 0.885 . . . . 0.0 109.517 -177.743 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -123.46 84.62 52.65 Favored Pre-proline 0 N--CA 1.403 -2.822 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.899 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.406 ' CG ' ' HB2' ' B' ' 137' ' ' LEU . 10.4 Cg_endo -53.87 115.95 2.68 Favored 'Trans proline' 0 N--CA 1.443 -1.468 0 C-N-CA 122.396 2.064 . . . . 0.0 109.072 171.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.47 118.05 67.92 Favored Pre-proline 0 N--CA 1.394 -3.225 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -168.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -78.92 -25.31 6.28 Favored 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 121.698 1.599 . . . . 0.0 109.537 172.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -167.42 145.43 4.0 Favored Pre-proline 0 CA--C 1.506 -0.731 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.23 -22.95 74.97 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.851 2.367 . . . . 0.0 114.167 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.19 -5.91 53.24 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.029 -1.044 . . . . 0.0 111.778 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.42 -8.36 59.05 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 40' ' ' MET . 28.6 mt -89.55 7.09 38.07 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.55 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -132.68 22.12 4.27 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.197 0.998 . . . . 0.0 108.944 177.186 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.589 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.3 t70 -95.61 172.68 7.91 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.058 -176.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.12 -22.84 64.86 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 122.794 0.437 . . . . 0.0 111.476 -178.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -79.05 -17.16 55.73 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.713 0.768 . . . . 0.0 109.416 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.589 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.3 tpp -62.98 -43.14 99.6 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.124 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -56.04 -38.84 71.12 Favored 'General case' 0 C--O 1.193 -1.873 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.082 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.416 HD22 HD22 ' B' ' 149' ' ' LEU . 2.8 t30 -68.09 -45.0 74.99 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.782 0.833 . . . . 0.0 111.546 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 37.4 mt -67.89 -43.44 79.31 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.184 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 p -73.25 -33.22 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.263 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.07 -44.05 97.51 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.517 0.675 . . . . 0.0 109.392 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.665 ' CE1' HG13 ' A' ' 26' ' ' ILE . 3.9 t80 -61.0 -47.19 87.59 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.263 174.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.13 97.32 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.501 -177.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -63.03 -46.3 88.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.898 176.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 19.7 pttp -64.06 -39.13 93.4 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 121.021 0.439 . . . . 0.0 110.528 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.58 -50.39 66.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.134 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -57.01 -47.79 80.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.719 0.807 . . . . 0.0 109.896 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -42.83 93.66 Favored Glycine 0 N--CA 1.446 -0.682 0 O-C-N 123.666 0.603 . . . . 0.0 112.632 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.35 -54.11 50.53 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.368 0.604 . . . . 0.0 110.564 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.517 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 ptp -67.16 -33.14 74.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.61 -50.96 71.86 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.01 -18.01 60.91 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.842 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -75.58 -54.52 6.87 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 122.374 0.269 . . . . 0.0 111.446 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.53 168.32 7.58 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.19 9.29 15.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.027 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.415 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 73.2 m -161.15 153.81 20.66 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 175.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.526 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.39 -39.58 74.46 Favored 'General case' 0 C--O 1.182 -2.472 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.461 -177.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.415 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 2.8 p-10 -62.78 -32.47 73.64 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 124.545 1.138 . . . . 0.0 109.479 176.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -71.96 -46.72 56.4 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.156 174.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.45 99.17 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.58 -49.06 77.63 Favored 'General case' 0 C--O 1.196 -1.731 0 C-N-CA 125.235 1.414 . . . . 0.0 109.381 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -66.12 -48.39 71.0 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 122.535 0.334 . . . . 0.0 111.669 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 3.8 pp -69.35 -29.96 67.88 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.642 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -75.93 -37.41 58.75 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.465 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -62.04 -35.93 80.09 Favored 'General case' 0 C--O 1.204 -1.317 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 7.2 mm-40 -59.89 -52.04 67.13 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.803 0.841 . . . . 0.0 110.263 172.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.73 -47.74 84.46 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.398 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.598 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.3 tt -68.16 -37.23 77.8 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.157 -177.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.506 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 13.0 t80 -56.88 -54.11 50.28 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 125.269 1.428 . . . . 0.0 111.395 176.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.4 ptpt -66.23 -32.28 73.61 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.411 -177.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.46 -39.54 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.684 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.0 mt-30 -66.2 -46.45 77.25 Favored 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.922 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.642 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.1 ptpt -75.2 -27.99 59.82 Favored 'General case' 0 N--CA 1.401 -2.92 0 C-N-CA 119.41 -0.916 . . . . 0.0 112.369 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 10.5 tp10 -57.54 -52.89 63.57 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.516 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -66.59 -41.55 88.33 Favored 'General case' 0 C--O 1.25 1.101 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.77 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.423 ' N ' HD13 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -60.77 -53.8 52.92 Favored 'General case' 0 N--CA 1.416 -2.165 0 C-N-CA 123.251 0.62 . . . . 0.0 110.433 -177.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -73.35 -32.31 64.46 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -175.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.522 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -65.6 -34.11 77.47 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.245 179.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.412 ' HG2' ' CD2' ' B' ' 137' ' ' LEU . 19.7 tpt180 -76.93 -35.92 56.97 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 121.619 0.723 . . . . 0.0 109.363 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -70.16 -58.43 3.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.066 -172.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.0 p -128.09 -64.42 0.96 Allowed 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -168.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.522 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 7.3 ptm180 -52.83 -26.53 14.83 Favored 'General case' 0 C--N 1.274 -2.691 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.175 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 82' ' ' LYS . 7.2 mp . . . . . 0 C--O 1.257 1.499 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 173.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . 0.482 ' HA2' ' O ' ' B' ' 104' ' ' SER . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 19.3 t -94.09 -19.51 20.76 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.061 0.458 . . . . 0.0 110.225 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.0 ttt -118.98 -48.92 2.43 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.482 ' O ' ' HA2' ' B' ' 101' ' ' GLY . 23.2 t -94.78 92.12 6.81 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 171.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -74.35 172.2 12.32 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.975 -1.012 . . . . 0.0 113.352 -169.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -103.76 49.23 0.83 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 105.838 -1.912 . . . . 0.0 105.838 172.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.88 83.12 0.16 Allowed Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.124 -175.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.499 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 28.4 p30 -101.3 14.44 31.96 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 123.851 0.86 . . . . 0.0 111.355 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -65.15 -36.75 85.22 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -170.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 33.9 m -61.63 -45.07 95.63 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 121.476 0.655 . . . . 0.0 109.417 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.57 -45.94 56.77 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.845 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 14.0 mm100 -60.48 -42.94 97.31 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.24 -47.6 79.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.426 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.98 -44.16 82.4 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.75 0.656 . . . . 0.0 109.624 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.48 -60.62 3.5 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.867 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 17.5 m -57.05 -48.79 77.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.86 0.362 . . . . 0.0 111.837 -173.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 m -69.94 -52.61 23.03 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.047 -174.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.18 -40.88 59.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.566 -174.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.592 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 33.1 t -64.27 -53.95 41.02 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 84.3 mt -67.68 -26.57 66.26 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 30.8 m -76.39 -47.78 22.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.059 0.457 . . . . 0.0 110.748 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -73.37 -29.58 62.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 68.2 p -79.41 -7.28 58.27 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.475 0.655 . . . . 0.0 110.474 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -86.61 -45.52 10.95 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.533 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -82.6 -79.41 1.0 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.927 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 169.83 45.24 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.963 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.816 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 52.37 41.14 54.71 Favored Glycine 0 N--CA 1.465 0.573 0 O-C-N 123.907 0.416 . . . . 0.0 114.088 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 9.2 m -106.17 117.37 33.87 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 101.59 3.18 53.11 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -76.24 118.54 5.35 Favored Glycine 0 N--CA 1.439 -1.161 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -164.99 150.61 18.77 Favored Glycine 0 N--CA 1.424 -2.159 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.777 -177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 20.4 t -170.68 162.03 7.68 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 104.913 -2.254 . . . . 0.0 104.913 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -127.28 -171.38 13.04 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.076 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -161.1 -58.38 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 127.64 -160.87 21.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.541 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.9 m -84.51 35.63 0.56 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.708 0.765 . . . . 0.0 109.973 -178.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.412 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 45.1 mt -85.45 -24.27 27.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.715 -175.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -42.94 98.36 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -175.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 2.8 p -69.13 -2.26 9.81 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -111.12 -41.76 4.11 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 173.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.531 ' SD ' HD12 ' B' ' 144' ' ' ILE . 14.5 tpt -57.95 -37.94 75.06 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.448 1.099 . . . . 0.0 109.822 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.469 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.0 mt-10 -48.98 -26.86 2.76 Favored 'General case' 0 C--O 1.187 -2.234 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 177.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.4 m -62.04 -60.33 3.77 Favored 'General case' 0 C--O 1.27 2.134 0 CA-C-N 119.391 0.996 . . . . 0.0 111.249 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.531 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.7 pp -72.53 -25.53 22.95 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 CA-C-O 122.492 1.139 . . . . 0.0 110.532 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' B' ' 149' ' ' LEU . 5.9 mm -70.48 -37.58 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.093 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.431 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.483 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 32.3 ttm180 -64.32 -36.55 84.48 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 m -57.83 -49.02 78.08 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.186 173.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -68.62 -41.63 79.21 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -77.27 -20.41 55.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.7 ttt -75.33 -31.62 60.64 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -89.7 171.16 9.85 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.62 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.665 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.624 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 86.8 t -102.79 133.56 46.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 10.1 tpt180 -84.99 108.99 17.86 Favored 'General case' 0 N--CA 1.414 -2.235 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.102 -172.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -121.67 120.17 33.94 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.69 -8.52 72.45 Favored Glycine 0 C--N 1.296 -1.692 0 C-N-CA 120.054 -1.069 . . . . 0.0 114.552 -173.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -75.74 -18.56 59.52 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.389 19.6 p80 -72.32 -0.52 12.53 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -174.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -90.56 -6.32 54.85 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.152 0.501 . . . . 0.0 109.878 173.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -106.72 11.99 29.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.206 0.527 . . . . 0.0 112.136 -176.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.46 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.7 p -129.05 109.9 19.67 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 CA-C-O 122.119 0.961 . . . . 0.0 109.51 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.0 m -73.87 150.74 40.75 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.842 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -38.36 84.64 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -61.29 -37.25 82.5 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.592 176.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -73.35 -45.51 54.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -173.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.4 ptm180 -70.41 -43.35 70.16 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.199 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.4 t -65.77 -28.07 68.75 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -64.97 -48.22 74.78 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -38.75 85.57 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.823 177.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.541 HG22 ' O ' ' A' ' 15' ' ' ARG . 95.0 t -57.46 -47.34 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.121 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.528 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.2 t-80 -62.98 -38.65 92.0 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.798 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.9 -35.6 77.04 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 119.11 -1.036 . . . . 0.0 111.538 175.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.58 -42.29 78.42 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.5 t -58.59 -50.25 79.67 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.713 173.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.4 mt-30 -62.52 -30.49 71.33 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.856 0.36 . . . . 0.0 111.64 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.35 -43.42 21.17 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.407 HG13 HG12 ' B' ' 145' ' ' ILE . 3.1 tt -70.68 -32.96 51.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.953 0.882 . . . . 0.0 109.62 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.544 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 79.1 t80 -125.37 84.96 59.13 Favored Pre-proline 0 N--CA 1.407 -2.594 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.531 -176.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -59.66 85.38 0.07 OUTLIER 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 123.073 2.516 . . . . 0.0 108.804 168.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -63.75 140.61 97.85 Favored Pre-proline 0 N--CA 1.424 -1.744 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -170.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.4 -21.19 6.52 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.945 2.43 . . . . 0.0 111.532 174.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -153.68 135.16 8.75 Favored Pre-proline 0 CA--C 1.505 -0.759 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -53.47 -24.25 27.68 Favored 'Trans proline' 0 CA--C 1.558 1.713 0 C-N-CA 122.726 2.284 . . . . 0.0 113.812 175.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.15 -14.7 59.36 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.826 -0.546 . . . . 0.0 111.68 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.66 -10.95 59.87 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.934 0.873 . . . . 0.0 109.494 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.2 mt -85.32 3.01 41.66 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.371 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -132.76 15.18 4.36 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.762 0.792 . . . . 0.0 110.052 177.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.559 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.3 t70 -74.93 175.63 7.91 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.947 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.557 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.06 -21.66 62.22 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.477 0.656 . . . . 0.0 110.417 178.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.426 ' NH1' ' HE1' ' A' ' 27' ' ' PHE . 60.0 ttt180 -75.52 -16.0 60.33 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.567 0.699 . . . . 0.0 109.2 176.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.65 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.58 -40.9 93.26 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.456 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -58.48 -32.13 68.48 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.233 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -72.02 -49.67 34.93 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 124.27 1.028 . . . . 0.0 110.774 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.71 -43.32 84.65 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.867 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.65 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -73.36 -28.05 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -61.25 -49.93 75.09 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.409 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -57.83 -46.16 85.13 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.998 175.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.31 90.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.512 0.196 . . . . 0.0 111.456 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -63.17 -44.62 94.93 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.205 0.602 . . . . 0.0 112.182 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.1 pttp -68.22 -36.95 80.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.188 0.518 . . . . 0.0 110.111 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.2 t -66.99 -47.72 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.612 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -55.52 -49.79 71.7 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.655 0.782 . . . . 0.0 108.999 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.44 84.84 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.922 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.12 -54.69 22.39 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.617 -0.343 . . . . 0.0 110.728 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.453 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.8 OUTLIER -66.78 -27.53 67.66 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.449 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.33 -53.75 47.73 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -67.7 -34.31 76.62 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.35 0.595 . . . . 0.0 111.574 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.453 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 33.8 m -68.53 -24.51 64.66 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.31 161.25 14.76 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -107.5 5.4 27.11 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.65 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.8 p -163.98 157.53 18.59 Favored 'General case' 0 CA--C 1.477 -1.833 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.46 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.27 -28.55 63.19 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.126 -178.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -67.06 -40.11 87.03 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -64.17 -45.27 89.15 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.463 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -43.6 92.95 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.889 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.67 ' CE1' HD12 ' B' ' 115' ' ' LEU . 10.9 t80 -60.68 -47.43 86.29 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.505 1.122 . . . . 0.0 109.944 178.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -63.38 -50.58 69.33 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 pp -70.55 -30.23 66.9 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.653 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.51 -43.28 69.98 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.475 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -55.34 -41.23 72.21 Favored 'General case' 0 C--O 1.202 -1.418 0 O-C-N 123.795 0.684 . . . . 0.0 110.795 173.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -56.96 -49.66 75.0 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 123.399 0.679 . . . . 0.0 111.718 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.416 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.53 -36.3 68.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.573 -177.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.7 tt -69.61 -35.69 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.525 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.4 t80 -56.65 -52.5 64.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.975 1.31 . . . . 0.0 110.593 175.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.02 -32.4 73.6 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.375 -177.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -65.37 -43.01 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 O-C-N 123.244 0.34 . . . . 0.0 110.743 177.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.9 mt-30 -63.06 -52.71 61.71 Favored 'General case' 0 CA--C 1.491 -1.311 0 O-C-N 123.757 0.661 . . . . 0.0 110.679 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.595 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.8 ptpt -72.39 -27.93 62.68 Favored 'General case' 0 N--CA 1.409 -2.493 0 C-N-CA 119.184 -1.006 . . . . 0.0 112.908 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 40.4 tp10 -57.48 -52.89 63.56 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.1 -43.18 75.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.591 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.511 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 74.2 mm-40 -61.63 -52.93 62.32 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.595 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.9 pt-20 -71.46 -32.67 68.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.411 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.474 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -71.54 -27.58 63.28 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.198 0.523 . . . . 0.0 110.458 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -73.11 -49.89 25.86 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.004 172.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 18.0 ptp180 -89.29 -56.18 3.37 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -171.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.9 p -134.02 -6.99 2.71 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 -167.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.474 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 2.4 ptp180 -87.55 -16.66 34.0 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 116.958 -1.897 . . . . 0.0 109.856 177.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.258 1.549 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 172.685 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.346 0 N-CA-C 111.665 -0.574 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 32.1 t -85.61 81.31 8.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 59.0 ttp -85.78 -52.07 6.0 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.691 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 25.2 t -74.22 115.02 13.24 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 177.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -91.23 164.89 13.73 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 120.967 0.413 . . . . 0.0 111.036 -173.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -83.91 26.0 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 C-N-CA 124.278 1.031 . . . . 0.0 109.506 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.11 57.21 4.86 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.833 -174.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 38.2 p30 -83.77 0.51 47.03 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -50.42 -43.19 54.8 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 124.797 1.239 . . . . 0.0 113.408 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.8 t -67.6 -35.83 79.7 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.584 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.41 -45.65 53.31 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.688 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 13.2 mm100 -64.22 -40.81 96.81 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.096 -178.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.36 -40.85 85.8 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.634 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 67.8 tp -56.28 -53.69 54.2 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.67 HD12 ' CE1' ' A' ' 65' ' ' TYR . 26.4 mt -51.59 -65.24 0.59 Allowed 'General case' 0 C--O 1.205 -1.261 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.274 176.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.7 m -59.37 -31.8 69.55 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.96 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 56.7 m -69.1 -47.89 63.99 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.124 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -76.5 -34.41 58.61 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.868 -176.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 66.7 p -73.89 -54.17 8.54 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.1 mt -81.79 -13.07 58.2 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.487 ' HA ' ' O ' ' B' ' 124' ' ' ASP . 73.9 m -69.3 -11.52 60.88 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.846 0.355 . . . . 0.0 111.9 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -61.13 -31.89 71.59 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 173.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.7 m -95.16 -61.74 1.43 Allowed 'General case' 0 N--CA 1.422 -1.873 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.613 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' B' ' 121' ' ' SER . 3.6 p30 -150.48 143.7 24.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 131.98 174.2 13.56 Favored Glycine 0 C--N 1.307 -1.04 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -122.06 19.85 8.18 Favored Glycine 0 C--N 1.31 -0.873 0 C-N-CA 121.016 -0.611 . . . . 0.0 111.973 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -70.02 120.16 9.4 Favored Glycine 0 N--CA 1.438 -1.18 0 N-CA-C 112.015 -0.434 . . . . 0.0 112.015 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.5 t -134.26 5.12 3.5 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.052 0.454 . . . . 0.0 110.021 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -63.88 149.42 50.59 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.186 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -144.11 -81.73 0.05 OUTLIER Glycine 0 N--CA 1.433 -1.559 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.774 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 166.24 -176.91 41.43 Favored Glycine 0 N--CA 1.438 -1.171 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.5 t -96.7 -22.59 16.9 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.9 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.51 -118.98 5.25 Favored Glycine 0 N--CA 1.426 -1.974 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -173.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 164.54 -70.14 0.2 Allowed Glycine 0 N--CA 1.438 -1.193 0 C-N-CA 119.079 -1.534 . . . . 0.0 113.713 175.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 127.99 -137.95 10.1 Favored Glycine 0 N--CA 1.428 -1.848 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.518 ' HA ' ' OE2' ' B' ' 138' ' ' GLU . 31.3 m -75.97 57.01 1.03 Allowed 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.1 mp -104.6 -33.3 8.57 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.544 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -66.04 -31.16 71.89 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.147 -1.388 . . . . 0.0 112.122 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 63.9 m -52.67 -33.54 47.73 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.417 0.687 . . . . 0.0 112.126 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -89.93 -38.09 13.92 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.972 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.501 ' SD ' HD12 ' B' ' 144' ' ' ILE . 9.7 tpt -60.71 -22.59 64.12 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.935 1.294 . . . . 0.0 109.587 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' B' ' 138' ' ' GLU . 51.3 mt-10 -54.78 -25.82 30.57 Favored 'General case' 0 C--O 1.194 -1.823 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.5 p -63.57 -59.82 4.13 Favored 'General case' 0 C--O 1.265 1.914 0 CA-C-N 119.54 1.064 . . . . 0.0 110.859 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.501 HD12 ' SD ' ' B' ' 141' ' ' MET . 9.0 pt -61.92 -35.41 67.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.736 0.779 . . . . 0.0 109.911 176.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.415 ' O ' ' HG ' ' B' ' 149' ' ' LEU . 1.4 mp -67.91 -34.29 66.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.069 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -65.18 -47.53 76.64 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 8.8 p -63.53 -33.91 76.64 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.987 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -80.68 -35.64 33.39 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -74.49 -23.59 58.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.023 0.374 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 59.7 ttp -57.33 -38.35 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 123.976 0.797 . . . . 0.0 109.605 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.7 t70 61.75 73.93 0.46 Allowed 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.795 1.238 . . . . 0.0 111.313 174.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.554 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.109 -178.797 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.553 0 N-CA-C 111.618 -0.593 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.5 m -117.03 129.27 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.724 0 CA-C-O 121.305 0.574 . . . . 0.0 110.221 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.41 134.87 37.34 Favored 'General case' 0 C--N 1.289 -2.042 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 175.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.5 ptpt -127.5 94.26 3.93 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.117 0.961 . . . . 0.0 111.196 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.64 0.13 10.83 Favored Glycine 0 CA--C 1.505 -0.536 0 CA-C-N 113.319 -1.764 . . . . 0.0 115.052 -173.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.534 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 68.1 p-90 -73.27 -9.13 58.38 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 117.392 0.596 . . . . 0.0 111.309 176.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -57.62 -21.94 42.46 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 121.475 0.655 . . . . 0.0 112.099 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.8 -19.51 58.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.557 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.57 4.07 54.31 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.716 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.535 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -130.64 109.48 17.05 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 178.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 m -74.86 154.36 38.27 Favored 'General case' 0 N--CA 1.413 -2.279 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -38.37 56.91 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.718 0.636 . . . . 0.0 110.261 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.669 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 13.9 t70 -60.41 -44.04 96.11 Favored 'General case' 0 C--O 1.179 -2.64 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.684 177.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.1 tm? -67.68 -51.58 47.98 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -171.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.554 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.5 ptm180 -60.38 -45.73 92.49 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.071 177.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -68.02 -22.25 64.98 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.953 0.882 . . . . 0.0 109.584 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.705 ' NE2' ' HA ' ' B' ' 119' ' ' SER . 2.1 t60 -71.61 -43.03 66.93 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.836 -1.074 . . . . 0.0 108.434 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.554 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -68.56 -33.6 74.37 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.735 176.013 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 15' ' ' ARG . 92.9 t -56.37 -48.14 80.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 O-C-N 123.773 0.671 . . . . 0.0 109.656 176.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.431 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 18.4 t-80 -66.2 -36.92 84.31 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.594 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HZ3' ' CD2' ' A' ' 17' ' ' HIS . 13.8 mptt -66.56 -35.24 79.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.89 175.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.412 HD11 ' HA ' ' A' ' 19' ' ' VAL . 80.8 mt -56.23 -46.04 79.7 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 175.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.9 t -57.32 -50.91 75.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 O-C-N 124.052 0.845 . . . . 0.0 111.165 173.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 68.6 mt-30 -60.57 -32.66 71.74 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -78.33 -46.18 20.75 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.959 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.555 HD12 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -70.28 -35.21 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.868 0.842 . . . . 0.0 109.621 -177.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.01 90.78 48.57 Favored Pre-proline 0 N--CA 1.402 -2.844 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.89 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.42 ' HB2' ' HA2' ' B' ' 134' ' ' GLY . 23.8 Cg_endo -64.98 95.14 0.24 Allowed 'Trans proline' 0 N--CA 1.443 -1.484 0 C-N-CA 121.788 1.659 . . . . 0.0 108.207 174.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' HB1' ' A' ' 34' ' ' ALA . 9.9 t -68.87 136.36 89.91 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.798 -170.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.82 -25.36 10.7 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.213 2.608 . . . . 0.0 111.482 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -149.15 144.49 18.07 Favored Pre-proline 0 CA--C 1.49 -1.361 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.41 -13.45 33.0 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.286 1.991 . . . . 0.0 112.575 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.99 -9.33 58.75 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.0 -0.438 . . . . 0.0 111.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.433 ' HB1' ' OG1' ' A' ' 29' ' ' THR . . . -79.76 -12.24 59.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.884 0.85 . . . . 0.0 109.034 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.3 mt -85.36 5.98 28.43 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.944 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.03 20.66 4.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.626 0.727 . . . . 0.0 109.736 177.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.599 ' O ' ' HB3' ' A' ' 40' ' ' MET . 23.4 t70 -81.65 175.94 10.06 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.85 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.56 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -71.17 -29.82 65.66 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.891 -0.506 . . . . 0.0 111.252 174.256 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -66.16 -23.45 66.47 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.945 0.879 . . . . 0.0 109.158 177.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.634 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -60.38 -36.78 78.88 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.951 176.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.8 pt-20 -61.46 -37.29 83.05 Favored 'General case' 0 C--O 1.2 -1.542 0 C-N-CA 118.444 -1.302 . . . . 0.0 109.672 -178.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -70.7 -43.04 69.84 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.727 0.811 . . . . 0.0 111.17 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.28 -43.82 73.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.641 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.634 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.3 p -73.3 -30.83 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.11 87.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 175.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.488 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.4 t80 -59.41 -46.78 87.74 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.546 175.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.39 -44.9 93.4 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.182 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -64.11 -42.8 96.74 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 122.938 0.495 . . . . 0.0 111.869 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 35.9 pttt -67.98 -40.13 83.18 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 -178.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.442 ' O ' ' HG2' ' A' ' 54' ' ' MET . 37.7 t -64.15 -50.47 76.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.933 178.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -56.19 -48.5 76.27 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.983 0.802 . . . . 0.0 109.24 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.86 96.28 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.079 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -60.25 -54.31 47.23 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.403 0.62 . . . . 0.0 110.034 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.462 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 ptp -67.76 -31.21 70.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.24 -35.72 80.13 Favored 'General case' 0 C--O 1.202 -1.432 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -20.57 37.3 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 121.296 -0.877 . . . . 0.0 111.748 177.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.3 t -80.65 -49.01 11.8 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.54 164.49 13.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -102.57 -5.01 24.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.988 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.2 m -157.81 154.17 27.64 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.535 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -63.6 -33.55 75.86 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.493 178.363 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -56.31 -47.49 78.59 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.44 0.638 . . . . 0.0 109.536 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.71 -45.03 80.05 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.753 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -41.01 98.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.626 ' CE1' HD11 ' B' ' 115' ' ' LEU . 8.5 t80 -63.19 -48.47 78.21 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.336 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.561 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m80 -67.25 -44.8 78.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 pp -70.27 -30.57 67.63 Favored 'General case' 0 C--O 1.254 1.341 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.157 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.462 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.27 -41.09 67.12 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.458 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -58.3 -35.09 71.32 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.616 0.767 . . . . 0.0 111.57 176.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 32.3 mm-40 -70.08 -42.86 72.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.055 0.455 . . . . 0.0 111.122 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.594 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.54 -39.51 70.64 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.723 -179.327 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.609 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -67.29 -34.64 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 2.7 t80 -53.75 -50.88 65.03 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 124.856 1.263 . . . . 0.0 110.756 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.0 ptpt -66.73 -33.66 76.13 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.5 0.5 . . . . 0.0 110.77 -176.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.31 -45.35 98.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.6 mt-30 -59.71 -46.52 88.85 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.777 -176.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -79.03 -27.01 43.16 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -59.97 -46.08 90.6 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.694 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.2 pp -68.81 -40.65 79.43 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.127 178.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 47.3 mt-10 -55.57 -52.75 62.7 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 121.11 0.481 . . . . 0.0 110.818 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.3 pt-20 -67.1 -39.38 86.7 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.206 -176.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.91 -32.15 63.41 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.344 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.47 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 2.0 ppt_? -74.39 -25.14 59.3 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.624 178.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -82.81 -40.54 20.25 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.0 t 78.07 90.39 0.06 Allowed 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.561 1.944 . . . . 0.0 108.314 -176.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.04 -17.06 59.82 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.13 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--N 1.312 -1.04 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.636 -178.091 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 N-CA-C 112.06 -0.416 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 69.7 m 64.12 84.84 0.14 Allowed 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.381 1.073 . . . . 0.0 113.257 -177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.6 ttt 72.72 9.32 5.59 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.814 -1.539 . . . . 0.0 112.92 174.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.1 m -65.32 -42.88 92.51 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 35.7 m-70 -119.7 104.89 10.64 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 170.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -111.07 167.04 10.56 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -174.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 93.56 -47.99 2.33 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.526 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 28.8 p-10 -94.57 -12.17 28.05 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 124.335 1.054 . . . . 0.0 112.035 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -54.77 -37.09 65.56 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 124.268 0.98 . . . . 0.0 112.763 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 6.5 t -71.83 -32.89 68.0 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 121.054 0.454 . . . . 0.0 110.203 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.13 -41.81 70.03 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 17.4 mm-40 -67.98 -40.92 83.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.33 -178.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.84 -47.99 83.86 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.585 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 tt -55.54 -49.77 71.79 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.626 HD11 ' CE1' ' A' ' 65' ' ' TYR . 51.8 mt -55.89 -67.54 0.28 Allowed 'General case' 0 C--O 1.21 -1.025 0 O-C-N 124.287 0.992 . . . . 0.0 111.451 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 22.5 m -58.82 -38.33 78.42 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.694 -169.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.8 m -69.76 -51.77 31.15 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.047 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.54 -33.63 58.55 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.517 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.705 ' HA ' ' NE2' ' A' ' 17' ' ' HIS . 22.6 t -69.75 -54.88 11.65 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -175.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.7 mt -78.04 -30.34 49.84 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -173.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 34.5 t -76.44 -39.83 52.28 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -91.13 -57.25 2.86 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -171.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 75.1 m 68.77 127.74 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.44 0 O-C-N 123.627 0.58 . . . . 0.0 109.953 -167.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 60.82 20.46 10.62 Favored 'General case' 0 N--CA 1.508 2.47 0 C-N-CA 123.233 0.613 . . . . 0.0 111.428 -170.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . 0.442 ' H ' ' CE1' ' A' ' 17' ' ' HIS . . . -76.29 120.43 5.85 Favored Glycine 0 C--O 1.252 1.245 0 CA-C-N 115.762 -0.653 . . . . 0.0 113.038 -176.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 155.46 121.61 0.75 Allowed Glycine 0 N--CA 1.421 -2.322 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.34 -68.74 0.36 Allowed Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 39.7 m -93.3 155.42 17.42 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 106.86 -2.38 35.87 Favored Glycine 0 N--CA 1.438 -1.211 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -140.52 -121.02 1.76 Allowed Glycine 0 N--CA 1.438 -1.181 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 86.56 -64.34 3.98 Favored Glycine 0 C--N 1.31 -0.909 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.481 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.1 t -72.36 -11.6 60.76 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 121.418 0.627 . . . . 0.0 110.532 -178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -92.37 25.44 18.02 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 28' ' ' PRO . . . -145.96 -165.52 11.48 Favored Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 130.51 -149.68 19.06 Favored Glycine 0 N--CA 1.435 -1.39 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.3 m -79.9 68.44 6.0 Favored 'General case' 0 C--O 1.25 1.126 0 CA-C-O 121.966 0.888 . . . . 0.0 111.925 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 8.0 mp -105.07 -26.35 12.16 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.715 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.478 ' CD ' ' H ' ' B' ' 139' ' ' CYS . 0.0 OUTLIER -73.11 -61.84 1.67 Allowed 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.812 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . 0.478 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 6.5 p 26.89 -91.89 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.581 1.953 . . . . 0.0 115.564 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.39 -29.56 70.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.047 1.339 . . . . 0.0 110.982 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.694 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.0 ttt -64.71 -22.92 67.09 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 123.768 0.827 . . . . 0.0 110.966 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.53 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.9 mt-10 -54.48 -27.18 36.0 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -61.32 -51.0 70.66 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.013 0.435 . . . . 0.0 110.668 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -75.34 -24.35 17.38 Favored 'Isoleucine or valine' 0 C--O 1.249 1.049 0 CA-C-O 122.015 0.912 . . . . 0.0 110.764 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.555 ' CG2' HD12 ' A' ' 26' ' ' ILE . 16.1 mm -65.94 -42.24 91.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.776 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -60.37 -40.17 89.87 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 123.861 0.864 . . . . 0.0 108.906 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.2 m -56.12 -45.93 79.33 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 123.553 0.533 . . . . 0.0 110.017 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -71.02 -50.07 38.12 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.2 pp -71.69 -31.5 66.83 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -173.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.439 ' N ' HD11 ' B' ' 149' ' ' LEU . 16.4 tpt -87.61 -18.51 29.49 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.0 t70 64.51 79.66 0.25 Allowed 'General case' 0 C--O 1.241 0.618 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.225 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.416 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.919 -176.553 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.487 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.69 107.08 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.09 107.61 10.18 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-O 121.622 0.725 . . . . 0.0 109.429 176.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.0 ptpt -102.95 91.46 4.14 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 122.234 1.016 . . . . 0.0 110.994 176.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.9 -6.5 18.5 Favored Glycine 0 C--O 1.235 0.215 0 CA-C-N 114.098 -1.41 . . . . 0.0 115.679 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.453 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.1 p-90 -69.51 -11.27 60.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 117.601 0.701 . . . . 0.0 111.094 177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.41 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 8.2 p80 -60.23 -23.03 63.73 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.936 0.398 . . . . 0.0 111.471 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -79.88 -6.55 57.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.3 0.572 . . . . 0.0 110.512 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -101.05 9.56 42.01 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.788 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.592 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -126.19 111.28 26.05 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.265 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 177.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -73.19 150.16 42.33 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.65 -37.99 59.54 Favored 'General case' 0 N--CA 1.441 -0.892 0 O-C-N 123.798 0.686 . . . . 0.0 110.075 176.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 12.4 m-20 -53.17 -44.75 68.11 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 175.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.6 ' O ' HD21 ' A' ' 18' ' ' LEU . 3.4 tm? -72.57 -54.14 9.99 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 -170.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.481 ' O ' HG21 ' A' ' 19' ' ' VAL . 2.1 ptm180 -59.79 -45.27 92.81 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 t -69.68 -25.56 63.95 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.484 0.659 . . . . 0.0 109.947 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.644 ' CE1' ' HA ' ' B' ' 119' ' ' SER . 19.5 t60 -65.92 -46.53 77.88 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.219 176.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.6 HD21 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -65.87 -34.5 78.29 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.259 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 15' ' ' ARG . 95.4 t -55.35 -47.32 78.14 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 CA-C-O 121.33 0.586 . . . . 0.0 109.736 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.48 -37.37 82.8 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.145 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.611 ' HZ2' ' CE1' ' A' ' 17' ' ' HIS . 12.6 mptt -64.54 -37.62 88.18 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.802 175.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 94.1 mt -56.67 -45.08 81.91 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.4 -53.84 43.26 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 O-C-N 123.508 0.505 . . . . 0.0 110.491 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.4 ' OE1' HD23 ' A' ' 35' ' ' LEU . 13.2 mm100 -53.22 -34.72 58.27 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -79.32 -46.15 18.25 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.567 HD13 ' CG2' ' B' ' 145' ' ' ILE . 5.5 tt -71.07 -33.25 50.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.311 0.577 . . . . 0.0 110.708 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -124.25 95.4 43.63 Favored Pre-proline 0 N--CA 1.409 -2.516 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.808 -176.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -62.37 109.56 0.88 Allowed 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.478 2.118 . . . . 0.0 110.414 173.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.82 119.58 76.15 Favored Pre-proline 0 N--CA 1.397 -3.091 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.6 -15.19 11.11 Favored 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 122.398 2.065 . . . . 0.0 110.844 176.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.13 143.31 4.4 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -59.88 -21.0 62.41 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.251 1.967 . . . . 0.0 113.346 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.13 -10.91 60.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.49 -0.756 . . . . 0.0 111.393 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.8 -13.93 59.97 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.682 0.753 . . . . 0.0 110.054 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.442 ' O ' ' HG2' ' A' ' 40' ' ' MET . 7.7 mt -88.41 5.34 42.72 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.172 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -133.66 20.42 3.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.892 0.854 . . . . 0.0 109.537 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.64 ' O ' ' HB3' ' A' ' 40' ' ' MET . 13.7 t70 -80.58 172.91 13.15 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.865 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.585 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -72.06 -26.48 62.2 Favored 'General case' 0 C--N 1.309 -1.172 0 O-C-N 121.592 -0.693 . . . . 0.0 110.455 175.259 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -67.57 -25.8 65.97 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.64 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 3.0 tpp -59.92 -41.14 91.08 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.902 -1.044 . . . . 0.0 112.248 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -64.94 -27.9 69.15 Favored 'General case' 0 C--O 1.206 -1.229 0 C-N-CA 118.648 -1.221 . . . . 0.0 109.916 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -74.03 -45.08 51.97 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.117 0.967 . . . . 0.0 110.337 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.99 -41.38 77.92 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.711 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.538 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.7 p -73.49 -30.47 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.29 -44.13 95.65 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.561 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 7.0 t80 -60.02 -51.09 71.14 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.203 172.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.21 -43.33 87.61 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.021 0.439 . . . . 0.0 111.223 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -66.25 -46.74 76.05 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 123.571 0.749 . . . . 0.0 111.838 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 12.5 pttp -63.79 -37.0 85.73 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 54' ' ' MET . 21.8 t -69.2 -53.15 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.295 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 55' ' ' TYR . 13.5 tm-20 -54.35 -50.5 67.3 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 124.198 0.936 . . . . 0.0 109.718 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.07 99.43 Favored Glycine 0 C--O 1.222 -0.651 0 O-C-N 123.576 0.547 . . . . 0.0 112.441 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -59.38 -52.2 66.64 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.227 0.537 . . . . 0.0 111.374 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 1.5 ptp -71.45 -27.51 63.31 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.41 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 40.9 t80 -64.26 -47.45 79.56 Favored 'General case' 0 C--O 1.206 -1.215 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 176.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -71.89 -25.71 62.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.26 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.5 t -80.84 -24.92 38.1 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.18 168.97 12.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -109.58 4.72 22.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.653 178.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.8 p -168.95 153.47 5.7 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.592 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -64.74 -33.83 76.9 Favored 'General case' 0 C--O 1.189 -2.109 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.812 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.77 -27.25 63.78 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.276 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 6.5 tp10 -75.32 -44.68 44.08 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 173.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -39.38 93.62 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.764 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.718 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 5.2 t80 -65.3 -46.99 78.18 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.069 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -56.4 -57.42 12.38 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 124.2 1.0 . . . . 0.0 111.697 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.9 pp -69.15 -30.32 68.53 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.487 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.52 -39.56 64.7 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.005 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.464 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -59.69 -38.8 82.57 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.091 176.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.69 -44.07 94.77 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.426 ' HB2' ' HZ2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -70.95 -36.85 72.76 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 119.327 -0.949 . . . . 0.0 111.361 -179.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.581 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.2 tt -69.98 -39.35 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.566 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.1 t80 -52.19 -53.29 45.1 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.073 1.349 . . . . 0.0 111.067 174.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -66.33 -34.01 77.02 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.007 -176.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.68 -42.84 93.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 O-C-N 123.426 0.454 . . . . 0.0 111.221 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 47.9 mt-30 -61.21 -48.77 79.99 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 121.414 0.625 . . . . 0.0 110.345 -178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.653 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.7 ptpt -74.93 -27.7 60.31 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.506 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -61.31 -47.78 84.4 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.78 -36.91 76.13 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.465 178.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.7 OUTLIER -61.72 -53.36 57.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.199 0.6 . . . . 0.0 110.96 179.426 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.653 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -73.01 -37.38 66.97 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -176.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.407 ' HD3' ' C ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -72.8 -39.12 66.95 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.215 -175.92 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.417 ' HG2' HD22 ' B' ' 137' ' ' LEU . 22.8 tpt180 -76.8 -31.73 57.16 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -62.61 -34.68 77.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.9 t 84.75 88.73 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.027 2.131 . . . . 0.0 110.029 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -80.87 -23.92 38.7 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.531 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--O 1.253 1.261 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.009 173.574 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.129 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 36.3 m -87.98 82.6 7.19 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.156 0.503 . . . . 0.0 110.44 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.94 91.9 8.78 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-O 121.871 0.843 . . . . 0.0 109.018 -179.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 49.2 m -156.33 121.5 4.72 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 -77.61 131.38 37.77 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -67.73 -27.35 66.73 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 80.41 4.86 90.03 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.522 176.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 37.2 p30 -100.73 13.55 34.52 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.096 0.475 . . . . 0.0 110.697 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -58.32 -57.42 12.97 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.926 -1.034 . . . . 0.0 108.398 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 35.1 m -63.23 -43.23 98.64 Favored 'General case' 0 N--CA 1.422 -1.871 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.751 178.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.83 -57.81 11.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.614 0.571 . . . . 0.0 112.237 -178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 6.5 mm100 -69.19 -36.67 77.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.611 -173.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -64.71 -47.9 76.63 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.261 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.02 -47.59 85.21 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.439 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.718 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 18.3 mt -51.57 -66.41 0.39 Allowed 'General case' 0 C--O 1.214 -0.771 0 O-C-N 124.131 0.895 . . . . 0.0 111.738 177.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 15.0 t -62.56 -35.54 79.81 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -169.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -76.57 -44.35 35.04 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.304 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' B' ' 122' ' ' HIS . 25.5 t70 -76.14 -27.79 57.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.077 0.465 . . . . 0.0 110.642 -175.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.644 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 19.8 t -76.82 -54.95 5.93 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.498 -0.481 . . . . 0.0 112.064 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.3 mt -77.79 -50.16 12.89 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 120.556 -0.458 . . . . 0.0 112.16 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.1 m -77.46 -28.07 52.28 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . 0.467 ' HB3' ' O ' ' B' ' 118' ' ' ASP . 6.7 t-160 -114.09 -8.01 13.04 Favored 'General case' 0 CA--C 1.562 1.423 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -170.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 39.7 t 69.07 -54.59 0.57 Allowed 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.751 1.22 . . . . 0.0 114.279 175.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -128.49 -59.55 1.15 Allowed 'General case' 0 CA--C 1.494 -1.195 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.42 -111.02 1.37 Allowed Glycine 0 C--O 1.242 0.647 0 O-C-N 124.643 1.215 . . . . 0.0 116.124 172.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -66.37 117.92 10.22 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.155 -0.523 . . . . 0.0 112.172 -175.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 169.23 50.69 0.03 OUTLIER Glycine 0 N--CA 1.411 -2.969 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.524 -178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.0 t -116.97 -58.15 2.1 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 130.35 -169.34 21.26 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 120.367 -0.921 . . . . 0.0 111.433 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 75.67 -134.63 16.67 Favored Glycine 0 N--CA 1.434 -1.448 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 68.02 -123.68 18.65 Favored Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 16.3 m -98.55 -11.23 22.41 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 120.597 0.237 . . . . 0.0 110.819 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -142.89 88.3 0.18 Allowed Glycine 0 CA--C 1.496 -1.12 0 C-N-CA 120.288 -0.958 . . . . 0.0 111.758 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -140.24 76.89 0.32 Allowed Glycine 0 N--CA 1.434 -1.498 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.089 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -175.03 176.23 47.14 Favored Glycine 0 CA--C 1.487 -1.699 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.4 m -73.17 89.77 1.54 Allowed 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.709 0.766 . . . . 0.0 112.163 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.417 HD22 ' HG2' ' A' ' 83' ' ' ARG . 29.0 mt -105.48 -21.8 13.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 176.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 1.6 pm0 -75.77 -11.63 60.03 Favored 'General case' 0 C--O 1.199 -1.593 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.918 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 9.8 p -55.1 -34.28 63.53 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.94 -33.85 57.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.219 1.009 . . . . 0.0 110.369 175.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.416 ' O ' HG12 ' B' ' 145' ' ' ILE . 92.1 mmm -80.92 -30.81 35.29 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.444 -172.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 44.9 mt-10 -47.63 -29.85 3.26 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -173.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 35.0 t -59.3 -59.6 5.2 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 120.878 0.37 . . . . 0.0 110.299 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -70.54 -24.32 25.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.615 0.722 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 13.3 mm -66.45 -49.95 71.19 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.604 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 19.1 mtp180 -66.25 -34.89 79.04 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 120.48 0.181 . . . . 0.0 110.902 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 t -57.22 -43.02 82.43 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 123.935 0.772 . . . . 0.0 109.111 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -77.1 -54.92 5.92 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.188 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.5 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.3 pp -65.17 -26.64 68.25 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 -172.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tpt -79.36 -23.23 43.5 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.379 -176.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.84 110.75 23.15 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.533 -175.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.457 ' CB ' ' HD2' ' A' ' 49' ' ' LYS . . . . . . . . 0 CA--C 1.509 -0.624 0 C-N-CA 126.85 2.06 . . . . 0.0 107.054 175.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.841 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 44.5 t -100.48 131.7 47.54 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -89.48 110.45 21.28 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -99.72 119.55 38.3 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.946 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -50.56 -29.8 18.6 Favored Glycine 0 C--O 1.239 0.456 0 O-C-N 124.292 0.995 . . . . 0.0 115.107 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.3 p-90 -67.48 -7.29 24.41 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -55.84 -30.36 61.33 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.024 0.44 . . . . 0.0 111.354 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -75.84 -10.46 59.45 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.046 0.45 . . . . 0.0 111.173 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -106.78 11.98 29.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.205 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.5 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.3 p -128.38 112.2 26.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 121.753 0.787 . . . . 0.0 109.685 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.411 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -74.62 150.07 39.78 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.963 -175.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -41.98 90.01 Favored 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -65.02 -29.4 70.31 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.384 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.498 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.2 tm? -74.41 -52.34 12.37 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 -177.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.546 ' O ' HG21 ' A' ' 19' ' ' VAL . 7.3 ptm180 -65.87 -42.29 90.56 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.57 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -69.68 -25.83 64.08 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.493 ' CD2' ' HB3' ' B' ' 119' ' ' SER . 73.0 t60 -66.73 -45.31 79.07 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 121.41 0.624 . . . . 0.0 109.599 175.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.498 HD11 ' O ' ' A' ' 14' ' ' LEU . 3.7 mp -62.7 -36.8 84.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.232 177.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.546 HG21 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -60.78 -48.75 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.318 0.647 . . . . 0.0 109.65 173.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.465 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 33.0 t-80 -55.12 -45.18 75.54 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.32 0.648 . . . . 0.0 110.767 177.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -66.39 -37.87 86.22 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.871 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.98 -43.16 86.39 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.465 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 18.6 t -54.55 -49.64 64.91 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 C-N-CA 123.964 0.906 . . . . 0.0 111.0 173.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.95 -15.93 61.1 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.655 -0.818 . . . . 0.0 113.112 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.08 -45.67 16.14 Favored 'General case' 0 C--O 1.208 -1.107 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.46 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.539 HD12 ' CG2' ' B' ' 145' ' ' ILE . 3.8 tt -70.53 -30.47 42.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 122.417 1.103 . . . . 0.0 109.885 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.48 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 85.3 t80 -134.85 83.37 41.13 Favored Pre-proline 0 N--CA 1.399 -3.007 0 CA-C-N 114.192 -1.367 . . . . 0.0 107.872 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.78 94.0 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.381 2.054 . . . . 0.0 108.284 170.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 t -63.78 126.99 91.0 Favored Pre-proline 0 N--CA 1.414 -2.263 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.862 -169.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -72.75 -26.4 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.78 2.32 . . . . 0.0 111.298 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.4 142.47 14.62 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.88 -25.14 34.11 Favored 'Trans proline' 0 CA--C 1.554 1.485 0 C-N-CA 122.562 2.175 . . . . 0.0 114.559 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.64 -10.81 59.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.258 -0.902 . . . . 0.0 111.82 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.55 59.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.577 0.703 . . . . 0.0 109.914 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -87.5 0.38 55.64 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.089 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HB3' ' HZ3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -132.86 34.37 3.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 122.002 0.906 . . . . 0.0 110.681 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.0 t70 -95.32 177.25 5.91 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.454 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.01 -25.67 62.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 121.723 -0.611 . . . . 0.0 109.778 176.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.5 ttm180 -66.24 -24.57 66.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.556 175.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.574 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 6.1 tpp -60.57 -43.74 96.95 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.54 -0.754 . . . . 0.0 112.38 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.423 ' HA ' HG13 ' A' ' 44' ' ' VAL . 11.3 pt-20 -67.56 -26.43 66.3 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 118.603 -1.239 . . . . 0.0 110.297 -177.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.41 ' OD1' HD21 ' B' ' 149' ' ' LEU . 5.5 t30 -73.1 -44.89 59.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.744 177.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 77.6 mt -69.78 -41.03 75.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.578 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.423 HG13 ' HA ' ' A' ' 41' ' ' GLU . 3.6 p -71.77 -28.18 29.98 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.668 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.2 87.04 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.273 0.559 . . . . 0.0 109.545 175.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.0 t80 -60.95 -45.87 92.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.294 174.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.84 97.92 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.418 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -62.56 -45.62 92.11 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.571 0.749 . . . . 0.0 112.225 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.6 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 12.7 pttp -63.91 -37.39 87.21 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.354 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 51.0 t -72.22 -47.71 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.321 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.74 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.12 -45.24 91.41 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.004 0.922 . . . . 0.0 109.863 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.88 -42.15 99.71 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.937 177.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.97 -54.11 50.59 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.376 0.27 . . . . 0.0 111.32 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.476 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -67.23 -30.98 71.03 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.401 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -59.31 -49.59 77.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -77.34 -21.67 53.01 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.324 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -80.97 -35.9 31.54 Favored 'General case' 0 CA--C 1.553 1.075 0 CA-C-O 120.609 0.242 . . . . 0.0 111.498 -178.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.58 167.84 16.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.133 0.492 . . . . 0.0 111.499 -178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -121.83 15.1 10.9 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.639 0.733 . . . . 0.0 110.503 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.5 m -156.0 148.92 24.2 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.5 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -68.04 -39.75 83.0 Favored 'General case' 0 C--O 1.191 -1.997 0 CA-C-O 121.034 0.445 . . . . 0.0 111.542 -179.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -67.71 -32.87 73.81 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 123.627 0.771 . . . . 0.0 108.982 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.56 -48.05 70.89 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.617 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -41.28 98.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.565 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -49.26 77.91 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.819 1.248 . . . . 0.0 109.764 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -64.1 -49.03 73.85 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.62 -30.45 68.18 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.75 -177.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.476 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -74.56 -35.99 63.08 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.62 -31.79 73.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -71.57 -43.2 66.75 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.035 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.404 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -71.41 -36.29 71.29 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.331 -179.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.561 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.4 tt -67.23 -39.78 83.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' B' ' 108' ' ' ASN . 26.5 t80 -55.24 -54.66 40.61 Favored 'General case' 0 C--O 1.262 1.716 0 C-N-CA 124.491 1.116 . . . . 0.0 111.291 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.1 ptpt -64.42 -34.67 78.73 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.229 -177.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.404 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.2 mp -64.14 -40.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 O-C-N 123.395 0.434 . . . . 0.0 111.187 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.1 mt-30 -65.76 -52.49 50.57 Favored 'General case' 0 CA--C 1.489 -1.375 0 CA-C-O 121.504 0.669 . . . . 0.0 110.471 -177.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -72.18 -27.93 62.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.31 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 37.2 tt0 -61.62 -51.97 66.3 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 123.635 0.584 . . . . 0.0 109.631 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -62.39 -40.31 96.07 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.489 -178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' N ' HD13 ' A' ' 79' ' ' LEU . 3.4 tm-20 -62.62 -49.74 73.98 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 123.366 0.666 . . . . 0.0 110.468 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -75.01 -35.49 61.97 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.78 -29.03 60.99 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.572 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -64.12 -46.25 85.02 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 173.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -62.69 -37.17 85.4 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.548 175.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . 0.251 49.7 m 86.86 69.57 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 125.891 1.676 . . . . 0.0 113.851 175.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -113.34 -17.43 12.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.45 170.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.117 1.367 . . . . 0.0 107.446 173.904 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.584 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -58.79 -50.32 74.37 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.304 0.642 . . . . 0.0 110.876 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 86.4 mtp -95.9 18.85 12.43 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.0 t -84.28 -16.93 41.36 Favored 'General case' 0 C--O 1.244 0.802 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -81.0 161.24 24.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -104.36 101.61 11.31 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.47 55.14 4.39 Favored Glycine 0 C--O 1.219 -0.802 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.532 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 31.2 p30 -98.54 2.54 47.61 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 123.671 0.789 . . . . 0.0 111.745 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.73 -46.15 58.99 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -171.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 5.1 t -65.3 -40.13 93.41 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.579 -0.448 . . . . 0.0 111.613 -177.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.35 -46.48 48.92 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.226 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -59.22 -42.24 90.53 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 120.967 0.413 . . . . 0.0 110.596 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.48 -43.59 89.75 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.851 176.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -55.96 -49.44 73.53 Favored 'General case' 0 C--O 1.264 1.823 0 CA-C-O 121.42 0.628 . . . . 0.0 109.868 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -53.51 -54.61 34.79 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.302 176.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 33.6 m -60.85 -43.16 98.7 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.273 0.983 . . . . 0.0 110.481 -176.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 40.2 t -58.45 -49.55 76.93 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.414 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -77.13 -52.48 9.2 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 117.679 -1.608 . . . . 0.0 112.828 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.493 ' HB3' ' CD2' ' A' ' 17' ' ' HIS . 77.6 p -77.01 -54.23 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -171.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.2 mt -81.98 -23.46 36.03 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -171.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 41.0 m -68.93 -53.79 19.01 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.508 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -112.74 -71.3 0.76 Allowed 'General case' 0 C--O 1.237 0.425 0 C-N-CA 118.49 -1.284 . . . . 0.0 109.668 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 74.0 p 166.63 97.03 0.0 OUTLIER 'General case' 0 C--O 1.248 1.004 0 C-N-CA 125.18 1.392 . . . . 0.0 107.491 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 20.3 t70 65.8 174.95 0.22 Allowed 'General case' 0 CA--C 1.555 1.16 0 O-C-N 123.683 0.614 . . . . 0.0 110.35 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -147.1 83.67 0.18 Allowed Glycine 0 N--CA 1.414 -2.788 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -68.71 91.73 0.27 Allowed Glycine 0 N--CA 1.436 -1.305 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 178.48 -96.98 0.1 Allowed Glycine 0 N--CA 1.422 -2.282 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.6 t -168.28 150.19 5.21 Favored 'General case' 0 N--CA 1.428 -1.526 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 154.44 104.88 0.24 Allowed Glycine 0 N--CA 1.425 -2.066 0 N-CA-C 109.039 -1.624 . . . . 0.0 109.039 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 156.66 -45.24 0.51 Allowed Glycine 0 C--N 1.289 -2.07 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -175.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.04 104.56 0.19 Allowed Glycine 0 N--CA 1.436 -1.334 0 N-CA-C 111.389 -0.684 . . . . 0.0 111.389 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.0 t -139.24 144.94 38.65 Favored 'General case' 0 N--CA 1.416 -2.167 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 111.51 41.97 1.09 Allowed Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.938 -0.648 . . . . 0.0 111.815 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -107.63 -147.88 13.81 Favored Glycine 0 N--CA 1.435 -1.404 0 N-CA-C 110.733 -0.947 . . . . 0.0 110.733 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 153.12 -42.57 0.65 Allowed Glycine 0 C--N 1.3 -1.448 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.6 m -139.24 8.04 2.44 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 122.369 -0.489 . . . . 0.0 111.885 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 6.5 mp -87.82 -32.43 19.05 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.671 0.748 . . . . 0.0 109.29 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.48 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 1.4 mp0 -62.63 -49.46 75.11 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.624 -1.171 . . . . 0.0 108.591 179.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 8.0 t -73.11 -15.8 61.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.36 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -76.48 -38.83 54.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.449 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.0 ttt -80.98 -14.58 57.83 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.722 0.809 . . . . 0.0 110.386 177.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' B' ' 146' ' ' ARG 0.282 21.0 mt-10 -49.57 -28.03 5.16 Favored 'General case' 0 C--O 1.187 -2.229 0 N-CA-C 116.574 2.064 . . . . 0.0 116.574 -176.415 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 p -54.79 -60.04 3.91 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 119.167 0.894 . . . . 0.0 111.274 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 pt -68.99 -25.47 30.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.753 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.573 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 17.4 mm -70.87 -40.52 76.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.196 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.747 177.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 24.5 mmm180 -60.83 -47.8 84.7 Favored 'General case' 0 CA--C 1.498 -1.019 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.4 p -60.11 -38.25 82.42 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 119.564 -0.854 . . . . 0.0 111.747 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.6 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 55.2 mm-40 -66.17 -57.56 7.36 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 175.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.41 HD21 ' OD1' ' A' ' 42' ' ' ASN . 4.3 pp -61.48 -23.75 66.1 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -173.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 70.0 mtm -86.47 -6.54 58.88 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.796 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -130.04 109.19 10.66 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 121.954 0.883 . . . . 0.0 112.968 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.618 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 174.621 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.455 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.26 108.01 14.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.019 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.44 70.55 1.98 Allowed 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 123.159 1.457 . . . . 0.0 107.849 172.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -128.55 118.91 23.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.611 -1.631 . . . . 0.0 107.904 -175.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.513 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -50.31 -30.44 18.31 Favored Glycine 0 CA--C 1.524 0.647 0 O-C-N 124.119 0.887 . . . . 0.0 114.678 -174.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.489 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 65.8 p-90 -71.31 -5.68 34.16 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.558 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 25.4 p80 -70.51 -11.89 61.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.91 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 13.1 pt-20 -90.71 -6.83 53.96 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.989 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.489 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 17.7 m-70 -95.08 5.88 50.62 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.408 0.683 . . . . 0.0 110.044 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.545 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.4 p -133.07 121.46 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 m -77.91 149.88 34.15 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -36.1 79.79 Favored 'General case' 0 C--O 1.205 -1.242 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -66.02 -29.26 69.6 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 177.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.516 ' O ' HD23 ' A' ' 18' ' ' LEU . 3.2 tm? -73.22 -51.55 17.29 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -177.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.508 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.3 ptm180 -65.14 -43.07 93.05 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.106 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.402 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 38.9 t -64.68 -28.83 69.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 121.464 0.649 . . . . 0.0 109.288 178.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -67.23 -43.86 80.93 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.637 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.516 HD23 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -63.46 -37.45 87.33 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.313 176.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 15' ' ' ARG . 89.7 t -55.03 -47.05 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.423 0.689 . . . . 0.0 109.595 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.438 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 13.2 t-80 -63.31 -37.05 85.75 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.313 178.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.66 -32.65 66.0 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 118.891 -1.124 . . . . 0.0 111.783 176.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.4 mt -57.06 -43.68 82.27 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 23.4 t -57.63 -46.79 86.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.1 172.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -69.96 -31.16 68.73 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -73.36 -45.9 52.31 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.441 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.564 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.3 tt -70.85 -33.74 53.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.393 0.616 . . . . 0.0 110.781 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.427 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 68.5 t80 -127.02 81.74 69.35 Favored Pre-proline 0 N--CA 1.418 -2.074 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.717 -174.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HG3' ' HB2' ' B' ' 137' ' ' LEU . 10.7 Cg_endo -53.57 120.15 7.36 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.346 2.697 . . . . 0.0 109.358 169.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.5 112.72 4.54 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 -170.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.38 -12.42 9.12 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 121.82 1.68 . . . . 0.0 108.498 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.547 ' HA ' ' O ' ' B' ' 131' ' ' GLY . 6.3 t70 -176.83 137.56 0.43 Allowed Pre-proline 0 CA--C 1.496 -1.126 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.93 -22.19 73.66 Favored 'Trans proline' 0 N--CA 1.45 -1.061 0 C-N-CA 121.989 1.793 . . . . 0.0 112.158 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.88 -3.47 57.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.914 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.07 -10.72 59.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.107 0.956 . . . . 0.0 108.453 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.84 5.4 25.28 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.627 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.6 16.92 3.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.638 0.733 . . . . 0.0 110.351 175.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.57 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.0 t70 -83.19 179.1 7.82 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.806 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.555 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -69.86 -26.76 64.36 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 12.1 ttm180 -68.03 -21.01 65.04 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.57 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 9.0 tpp -63.44 -44.01 95.77 Favored 'General case' 0 C--O 1.206 -1.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.315 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.1 pt-20 -62.62 -30.02 71.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 119.347 -0.941 . . . . 0.0 109.73 -177.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.426 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.9 t30 -71.41 -47.65 54.69 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 124.57 1.148 . . . . 0.0 110.309 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 82.5 mt -69.11 -41.8 76.93 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.391 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.499 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -73.32 -27.82 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.404 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -63.09 -48.78 77.12 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.537 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 3.1 t80 -56.23 -42.41 77.25 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.108 0.563 . . . . 0.0 109.889 173.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.84 -42.52 85.61 Favored 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.083 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -64.44 -42.48 95.97 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.508 0.323 . . . . 0.0 111.638 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 5.1 ptmt -63.02 -44.81 94.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.244 176.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 52.7 t -63.66 -50.04 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.602 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -56.28 -46.7 79.61 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 109.201 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . -59.53 -44.06 97.07 Favored Glycine 0 N--CA 1.443 -0.847 0 O-C-N 123.945 0.778 . . . . 0.0 112.335 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.69 -54.36 47.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 122.787 0.435 . . . . 0.0 110.838 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.0 OUTLIER -68.22 -31.97 71.85 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.558 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 83.9 t80 -61.74 -46.35 90.01 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 123.703 0.801 . . . . 0.0 109.848 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 52' ' ' GLY . 35.5 mt-10 -80.1 -22.75 41.84 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.016 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 46.4 m -76.35 -30.61 57.69 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.86 167.27 15.31 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -115.04 7.43 15.5 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.47 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.421 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 70.0 m -159.97 153.66 22.71 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.545 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -71.16 -36.63 72.08 Favored 'General case' 0 C--O 1.179 -2.617 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -177.943 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.421 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 5.2 p-10 -70.07 -27.29 64.5 Favored 'General case' 0 C--N 1.29 -1.982 0 C-N-CA 124.17 0.988 . . . . 0.0 108.792 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.46 -46.75 46.42 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.19 99.28 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.493 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 1.2 t80 -55.0 -49.5 71.36 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.317 1.447 . . . . 0.0 109.591 174.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -64.49 -53.97 39.72 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.169 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.6 pp -69.03 -30.02 68.3 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.94 -176.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.0 OUTLIER -70.4 -39.53 74.42 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.444 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -63.02 -34.43 77.56 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 123.567 0.542 . . . . 0.0 110.096 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -71.08 -38.71 72.42 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.636 176.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -76.24 -35.46 58.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 118.976 -1.09 . . . . 0.0 111.236 -179.269 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.592 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.3 tt -67.75 -36.91 77.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.553 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.5 t80 -53.23 -53.01 56.95 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.133 1.373 . . . . 0.0 111.263 174.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.3 ptpt -67.84 -31.97 72.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.784 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.48 -43.38 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 O-C-N 123.402 0.439 . . . . 0.0 110.09 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.2 mt-30 -62.9 -54.28 41.04 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.093 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.4 ptpt -68.54 -27.87 66.48 Favored 'General case' 0 N--CA 1.398 -3.063 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.431 -176.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -62.88 -52.57 62.58 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 177.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -64.31 -38.06 89.69 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.66 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.88 -41.37 87.34 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 123.489 0.493 . . . . 0.0 111.686 178.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.2 pt-20 -72.7 -42.65 63.97 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -178.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HE2' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.86 -34.91 64.67 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -72.43 -49.89 30.28 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -69.52 -35.57 75.61 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.3 m 72.78 72.8 0.14 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.6 -1.636 . . . . 0.0 109.888 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -93.76 -10.75 33.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.58 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.254 1.337 0 CA-C-N 114.235 -1.348 . . . . 0.0 109.919 -178.59 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.807 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 38.6 t -112.15 142.72 44.27 Favored 'General case' 0 N--CA 1.418 -2.04 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 65.0 mtt -105.67 15.57 26.69 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.0 m -84.28 92.56 8.02 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.315 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -94.26 102.85 14.88 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -150.91 173.78 13.88 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -177.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.02 53.67 9.06 Favored Glycine 0 CA--C 1.498 -1.008 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 39.1 p-10 -118.1 17.4 14.05 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.125 -1.038 . . . . 0.0 109.711 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.94 -50.17 58.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.8 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -63.76 -43.9 95.05 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 122.735 0.414 . . . . 0.0 110.34 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 3.2 mm? -63.56 -52.45 61.03 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.209 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -68.79 -44.32 73.86 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.229 -178.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.56 -41.11 98.43 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.353 0.408 . . . . 0.0 110.977 -178.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.49 -45.87 87.81 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 49.1 mt -57.73 -58.55 7.84 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.102 177.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.7 m -55.32 -38.95 69.37 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.307 0.575 . . . . 0.0 111.167 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' B' ' 121' ' ' SER . 28.2 p -77.63 -43.8 30.32 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.566 -175.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' B' ' 122' ' ' HIS . 20.3 t0 -74.64 -37.62 62.73 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.624 -176.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' B' ' 123' ' ' SER . 68.3 p -76.78 -53.72 7.56 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -177.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 92.9 mt -82.08 -54.08 5.58 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.952 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' B' ' 117' ' ' SER . 13.7 m -72.56 -47.8 45.25 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 47.7 m170 -81.64 -49.38 10.56 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 110.823 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' B' ' 119' ' ' SER . 50.4 m 74.86 -63.01 0.44 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.391 1.476 . . . . 0.0 112.528 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -111.69 148.62 33.04 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 116.789 -0.187 . . . . 0.0 110.808 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 155.55 73.93 0.01 OUTLIER Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -132.52 150.84 19.77 Favored Glycine 0 C--N 1.304 -1.243 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.252 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 83.37 -10.28 59.28 Favored Glycine 0 C--N 1.314 -0.668 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.788 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 22.6 t -133.64 131.11 39.19 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 171.06 -155.77 25.23 Favored Glycine 0 N--CA 1.43 -1.728 0 N-CA-C 109.394 -1.483 . . . . 0.0 109.394 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -102.83 154.51 18.28 Favored Glycine 0 C--N 1.307 -1.036 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.912 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . 0.547 ' O ' ' HA ' ' A' ' 31' ' ' ASP . . . 136.77 108.99 0.92 Allowed Glycine 0 N--CA 1.429 -1.78 0 N-CA-C 111.721 -0.552 . . . . 0.0 111.721 178.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 12.7 p -126.65 11.25 7.28 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 122.01 0.91 . . . . 0.0 109.905 175.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 110.17 -171.44 14.84 Favored Glycine 0 N--CA 1.424 -2.161 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.63 -10.4 45.35 Favored Glycine 0 C--N 1.314 -0.66 0 CA-C-N 117.372 0.586 . . . . 0.0 112.662 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -148.71 36.59 1.06 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 108.912 -1.675 . . . . 0.0 108.912 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 6.4 p -94.68 92.81 7.19 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 122.104 0.954 . . . . 0.0 109.904 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.411 ' HB2' ' HG3' ' A' ' 28' ' ' PRO . 9.2 mp -84.04 -15.05 48.96 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.679 -1.146 . . . . 0.0 112.433 -177.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.427 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -55.81 -37.81 69.14 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.033 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -70.68 75.59 0.59 Allowed 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 121.499 0.666 . . . . 0.0 111.108 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 61.7 t0 164.27 -59.6 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 128.007 2.523 . . . . 0.0 105.26 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.677 ' SD ' HD12 ' B' ' 144' ' ' ILE . 14.0 tpt -58.05 -37.09 73.73 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 113.964 -1.471 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.432 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 24.6 tt0 -53.97 -27.15 29.55 Favored 'General case' 0 CA--C 1.567 1.627 0 C-N-CA 124.793 1.237 . . . . 0.0 112.298 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -63.27 -59.41 4.76 Favored 'General case' 0 C--O 1.276 2.46 0 CA-C-O 121.282 0.563 . . . . 0.0 110.756 178.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.677 HD12 ' SD ' ' B' ' 141' ' ' MET . 46.7 pt -62.95 -28.53 45.23 Favored 'Isoleucine or valine' 0 C--N 1.354 0.773 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.564 ' CG2' HD11 ' A' ' 26' ' ' ILE . 10.6 mm -65.27 -43.69 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.839 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.1 177.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.455 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 74.9 mtt85 -63.55 -40.94 98.3 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 119.97 -0.692 . . . . 0.0 111.689 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.8 p -66.6 -26.21 66.98 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.383 176.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -80.59 -49.82 10.8 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.864 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.455 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.7 pp -67.39 -29.22 68.68 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.67 -0.644 . . . . 0.0 111.446 -176.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 39.2 tpp -67.36 -29.26 68.75 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.17 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -96.92 116.25 28.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.555 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -179.959 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.189 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.1 t -84.13 111.12 19.57 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -79.3 118.76 21.51 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.955 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.573 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 46.0 mttp -118.73 99.64 6.9 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -22.88 36.11 Favored Glycine 0 C--O 1.247 0.915 0 O-C-N 123.968 0.792 . . . . 0.0 114.134 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.573 ' NE1' ' HB3' ' A' ' 4' ' ' LYS . 66.5 p-90 -64.17 -10.06 20.71 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -60.24 -27.71 67.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.992 0.425 . . . . 0.0 111.24 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.59 -5.45 59.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.105 0.478 . . . . 0.0 111.062 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -96.52 -24.75 15.92 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.554 0.692 . . . . 0.0 110.153 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -96.71 124.36 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.661 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.749 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 m -86.08 151.62 23.54 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.061 -176.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -42.21 78.0 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 122.996 0.519 . . . . 0.0 110.291 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -61.45 -31.74 71.7 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.596 ' O ' HD21 ' A' ' 18' ' ' LEU . 3.4 tm? -72.64 -52.32 15.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 -174.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.5 ptm180 -62.58 -45.99 90.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.96 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 m -67.13 -23.48 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.033 0.444 . . . . 0.0 110.561 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.471 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 25.4 t60 -68.59 -45.18 72.71 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.596 HD21 ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -62.19 -38.69 90.07 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.674 177.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 15' ' ' ARG . 94.2 t -54.72 -47.77 73.27 Favored 'Isoleucine or valine' 0 C--O 1.256 1.4 0 C-N-CA 123.138 0.575 . . . . 0.0 110.235 176.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -58.64 -44.75 90.16 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.132 178.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.13 -29.75 65.64 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' A' ' 19' ' ' VAL . 74.1 mt -56.99 -45.17 83.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 175.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.412 HG11 ' HE2' ' A' ' 40' ' ' MET . 15.3 t -61.95 -51.44 72.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 O-C-N 123.799 0.687 . . . . 0.0 111.436 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.433 ' HB3' ' H ' ' B' ' 129' ' ' GLY . 23.5 mm-40 -63.97 -25.81 68.3 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.341 -175.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.447 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.34 -45.52 16.04 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.587 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.489 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.2 tt -70.57 -31.0 44.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.523 0.677 . . . . 0.0 109.391 -177.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.435 ' CD2' ' HG2' ' B' ' 138' ' ' GLU . 1.5 m-85 -127.93 90.43 47.73 Favored Pre-proline 0 N--CA 1.407 -2.616 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.086 -176.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -65.09 104.31 0.58 Allowed 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 121.848 1.698 . . . . 0.0 108.156 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.43 117.65 17.85 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 118.203 2.668 . . . . 0.0 118.203 -168.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -80.05 -19.52 9.39 Favored 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 122.468 2.112 . . . . 0.0 110.251 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -156.94 144.65 14.02 Favored Pre-proline 0 CA--C 1.483 -1.601 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.95 -12.47 26.1 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.145 1.23 . . . . 0.0 110.167 174.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.04 -13.75 60.9 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.069 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -21.66 63.38 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.67 0.748 . . . . 0.0 109.601 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.41 2.11 54.92 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.346 -178.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -136.09 19.01 3.21 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.529 0.681 . . . . 0.0 110.222 173.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.531 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 18.1 t70 -88.61 -179.37 6.02 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.531 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.88 -28.25 64.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 174.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.6 -23.14 66.76 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.483 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.66 -40.61 97.6 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 179.097 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -65.56 -36.97 85.34 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.526 -178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.48 -43.67 93.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.504 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.51 -43.35 63.7 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.168 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 p -73.47 -34.35 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.812 -179.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.13 95.15 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 175.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.505 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -61.54 -48.63 80.14 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.787 173.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.29 96.78 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 96.8 mttt -67.07 -45.04 78.54 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.259 0.624 . . . . 0.0 111.764 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.0 pttp -64.69 -40.24 95.06 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 54' ' ' MET . 20.7 t -64.91 -51.43 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.229 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.267 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -54.33 -51.31 65.12 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.932 0.893 . . . . 0.0 109.967 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -36.56 93.59 Favored Glycine 0 CA--C 1.52 0.385 0 CA-C-N 116.295 -0.411 . . . . 0.0 113.131 -179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.86 -54.32 48.39 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.793 0.806 . . . . 0.0 108.829 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.556 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.4 ptp -74.31 -28.43 61.16 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.519 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.433 ' HA ' ' CD1' ' A' ' 64' ' ' TYR . 72.5 t80 -59.23 -52.43 65.71 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 174.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -71.82 -27.86 63.2 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.123 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -71.72 -22.63 61.6 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 122.599 0.36 . . . . 0.0 111.638 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.02 168.31 10.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.446 0.641 . . . . 0.0 112.3 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -121.13 13.85 11.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.469 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -156.71 151.48 25.85 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.539 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.8 -36.5 67.59 Favored 'General case' 0 C--O 1.179 -2.614 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.554 177.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.25 -30.52 70.98 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 12.9 tp10 -71.75 -48.08 49.3 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.625 176.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.433 ' CD1' ' HA ' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -61.9 -39.4 91.87 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.602 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.499 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.5 OUTLIER -58.79 -48.23 82.01 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 124.604 1.161 . . . . 0.0 109.131 173.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -64.49 -55.62 19.52 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 122.921 0.488 . . . . 0.0 110.375 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -64.84 -30.45 71.45 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.496 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -76.1 -38.52 56.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.041 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.449 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.08 -36.25 82.96 Favored 'General case' 0 C--O 1.19 -2.069 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.71 -44.22 90.95 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.122 0.969 . . . . 0.0 112.407 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.448 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.87 -35.31 67.15 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.973 -178.581 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.613 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.5 tt -72.02 -35.67 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.575 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.16 -52.52 60.87 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 125.799 1.64 . . . . 0.0 110.818 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -67.29 -35.1 78.79 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.544 0.528 . . . . 0.0 110.584 -177.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.75 -42.18 95.07 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.6 mt-30 -63.59 -49.6 72.71 Favored 'General case' 0 CA--C 1.492 -1.278 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.1 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.615 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.4 ptpt -73.46 -29.4 62.51 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.939 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.2 tp10 -58.98 -52.45 65.7 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.69 -39.06 84.44 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.942 -178.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.39 -52.98 59.36 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.246 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.0 pt-20 -69.74 -34.15 73.45 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -65.65 -33.92 77.02 Favored 'General case' 0 C--N 1.347 0.481 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.088 178.415 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -77.35 -51.66 10.47 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.15 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.401 ' C ' ' HG ' ' A' ' 85' ' ' SER . 61.2 ttt180 -70.48 -60.38 2.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -171.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.401 ' HG ' ' C ' ' A' ' 84' ' ' ARG . 49.4 m -166.1 95.09 0.57 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HG3' ' HG ' ' A' ' 87' ' ' LEU . 30.4 ptt180 -178.34 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 124.246 1.018 . . . . 0.0 109.108 169.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.415 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 78.0 mt . . . . . 0 C--O 1.259 1.568 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.651 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.5 m -137.3 152.09 49.38 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.104 -0.548 . . . . 0.0 110.473 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 14.7 tpt -130.42 80.77 1.97 Allowed 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 5.1 p -90.49 -36.02 14.76 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.712 -1.131 . . . . 0.0 112.06 -174.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -95.74 97.43 9.69 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -126.44 94.98 4.22 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-O 122.016 0.912 . . . . 0.0 109.682 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -108.15 -12.31 22.19 Favored Glycine 0 N--CA 1.437 -1.274 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -79.28 14.32 1.57 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -51.02 -57.72 7.89 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 124.909 1.284 . . . . 0.0 111.227 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.2 m -57.01 -43.72 82.07 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.936 -178.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 2.9 mm? -69.61 -52.22 27.99 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.505 -175.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -66.16 -43.98 85.41 Favored 'General case' 0 CA--C 1.503 -0.846 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.199 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.99 -43.96 97.74 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 123.68 0.612 . . . . 0.0 110.814 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.36 -45.02 92.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.119 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 66.5 mt -57.03 -62.95 1.39 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.499 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 12.2 t -60.49 -32.77 71.75 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 120.909 0.385 . . . . 0.0 111.722 -174.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 36.9 m -71.74 -49.14 41.83 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.322 0.582 . . . . 0.0 110.329 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.626 ' O ' ' HB3' ' B' ' 122' ' ' HIS . 23.3 t70 -76.06 -30.22 58.29 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.536 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.471 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 22.8 t -78.31 -55.2 5.43 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.92 -47.9 12.16 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -171.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.7 m -74.7 -38.64 62.31 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.059 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . 0.626 ' HB3' ' O ' ' B' ' 118' ' ' ASP . 48.8 t60 -93.0 -7.81 44.8 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -175.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 47.4 t 74.23 -68.25 0.22 Allowed 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.496 1.118 . . . . 0.0 112.06 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -169.31 162.9 10.65 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 -175.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 167.34 -149.6 15.15 Favored Glycine 0 N--CA 1.414 -2.784 0 C-N-CA 119.789 -1.195 . . . . 0.0 112.253 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -113.78 45.63 1.29 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 111.556 -0.618 . . . . 0.0 111.556 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -66.09 95.11 0.23 Allowed Glycine 0 CA--C 1.508 -0.404 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.0 m -89.34 147.53 24.03 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 120.801 0.334 . . . . 0.0 110.203 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . 0.433 ' H ' ' HB3' ' A' ' 24' ' ' GLN . . . -115.91 158.92 14.12 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 110.26 -78.3 0.24 Allowed Glycine 0 N--CA 1.416 -2.635 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 178.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 83.7 -61.61 4.72 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 108.875 -1.69 . . . . 0.0 108.875 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.9 p -82.74 82.84 7.91 Favored 'General case' 0 N--CA 1.407 -2.588 0 CA-C-O 121.661 0.743 . . . . 0.0 109.563 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -137.09 136.4 8.28 Favored Glycine 0 N--CA 1.424 -2.148 0 N-CA-C 109.314 -1.515 . . . . 0.0 109.314 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 144.35 -55.46 0.56 Allowed Glycine 0 C--N 1.293 -1.86 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -83.11 80.92 1.78 Allowed Glycine 0 CA--C 1.493 -1.301 0 N-CA-C 107.171 -2.372 . . . . 0.0 107.171 172.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.519 ' HA ' ' OE2' ' B' ' 138' ' ' GLU . 73.4 m -33.35 111.39 0.1 Allowed 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -170.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 4.0 mp -96.93 -21.42 17.46 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.044 -1.889 . . . . 0.0 106.15 173.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' B' ' 136' ' ' SER . 1.3 mp0 -60.72 -41.93 96.24 Favored 'General case' 0 C--O 1.184 -2.368 0 CA-C-N 114.099 -1.41 . . . . 0.0 110.771 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 66.4 m -49.24 -48.4 45.73 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -174.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.14 -32.91 67.34 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.775 0.798 . . . . 0.0 109.559 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.469 ' SD ' HD12 ' B' ' 144' ' ' ILE . 11.1 tpt -70.6 -38.67 74.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.833 -176.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.504 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 48.4 mt-10 -53.22 -27.24 20.94 Favored 'General case' 0 C--O 1.202 -1.411 0 C-N-CA 124.823 1.249 . . . . 0.0 113.716 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.9 m -65.07 -57.33 8.9 Favored 'General case' 0 C--O 1.263 1.795 0 CA-C-O 121.274 0.559 . . . . 0.0 110.184 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.469 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.9 pp -72.55 -25.49 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.711 0.767 . . . . 0.0 110.563 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.504 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.6 mm -71.14 -33.5 51.37 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.807 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.459 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.4 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 21.8 tpt180 -62.53 -44.72 95.66 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -58.61 -50.74 72.72 Favored 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.123 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.01 -47.05 87.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.773 1.229 . . . . 0.0 112.956 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.468 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.2 pp -71.0 -30.89 67.25 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.85 -0.531 . . . . 0.0 111.546 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 51.7 tpp -76.09 -53.25 8.6 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.502 -178.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -112.54 -75.01 0.61 Allowed 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.202 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 179.896 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.391 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -85.76 141.16 14.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 122.247 -0.561 . . . . 0.0 110.024 177.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.08 119.13 35.0 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.011 -178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -113.9 137.01 52.26 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -50.53 -31.4 21.71 Favored Glycine 0 N--CA 1.465 0.62 0 O-C-N 124.157 0.911 . . . . 0.0 115.309 -173.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.95 -5.04 27.9 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -63.29 -17.27 62.34 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.25 0.547 . . . . 0.0 111.048 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.29 -22.2 61.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.04 0.448 . . . . 0.0 110.393 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -96.45 3.06 53.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.426 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -134.07 117.23 24.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.692 0.758 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.433 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -97.35 168.38 10.44 Favored 'General case' 0 N--CA 1.402 -2.828 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -56.75 -45.82 81.8 Favored 'General case' 0 C--O 1.198 -1.641 0 O-C-N 124.659 1.225 . . . . 0.0 109.667 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 5.5 p-10 -55.49 -37.46 67.85 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.4 -48.54 33.11 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.7 ptm180 -69.2 -41.68 76.81 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.447 -177.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -71.78 -23.63 61.61 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.582 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 16.7 t60 -72.34 -39.76 67.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD21 HD22 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -67.3 -35.58 79.75 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.847 175.426 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 15' ' ' ARG . 98.7 t -58.92 -40.33 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 172.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -62.55 -44.13 97.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.859 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.533 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.6 mptp? -68.89 -35.93 77.47 Favored 'General case' 0 CA--C 1.503 -0.837 0 C-N-CA 120.204 -0.598 . . . . 0.0 112.321 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 mt -54.84 -43.37 72.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.2 t -62.29 -50.44 79.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.55 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -66.01 -22.34 66.45 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.903 -176.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.419 ' HB2' ' HG2' ' A' ' 76' ' ' GLN . . . -81.84 -46.23 14.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 177.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.528 HD13 ' CG2' ' B' ' 145' ' ' ILE . 3.6 tt -70.88 -29.33 36.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.604 0 CA-C-O 122.294 1.045 . . . . 0.0 108.891 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.536 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 87.9 t80 -129.05 89.31 48.95 Favored Pre-proline 0 N--CA 1.391 -3.385 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.858 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.412 ' HG2' ' HG3' ' B' ' 138' ' ' GLU . 10.2 Cg_endo -52.89 129.51 33.3 Favored 'Trans proline' 0 N--CA 1.444 -1.395 0 C-N-CA 121.954 1.769 . . . . 0.0 108.446 170.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.406 ' CG2' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -86.23 117.54 68.86 Favored Pre-proline 0 N--CA 1.408 -2.547 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -169.079 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -78.43 -23.93 8.18 Favored 'Trans proline' 0 N--CA 1.443 -1.479 0 N-CA-C 108.995 -1.194 . . . . 0.0 108.995 172.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -170.25 145.13 2.23 Favored Pre-proline 0 N--CA 1.44 -0.936 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.423 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.51 -20.39 40.94 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.832 2.355 . . . . 0.0 113.596 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.67 -11.52 59.88 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.064 -1.022 . . . . 0.0 112.555 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.17 -6.43 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.74 0.781 . . . . 0.0 109.129 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.445 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.2 mt -89.92 7.2 38.52 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.716 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -129.88 15.41 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.93 0.871 . . . . 0.0 109.187 175.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.623 ' O ' ' HB3' ' A' ' 40' ' ' MET . 27.7 t70 -81.75 176.38 9.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.748 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.82 -27.47 63.9 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.034 0.445 . . . . 0.0 110.718 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.599 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.1 ttp180 -72.98 -17.1 61.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.623 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 4.4 tpp -63.08 -45.48 91.93 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.138 176.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.06 -31.16 72.24 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.711 -175.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.452 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -67.56 -49.18 64.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.375 1.47 . . . . 0.0 110.021 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 76.9 mt -67.78 -44.62 76.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.458 -177.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.489 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.4 p -71.81 -30.32 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.346 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.167 -177.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.18 -48.69 80.66 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.2 t80 -59.06 -46.64 87.74 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.468 174.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.16 95.23 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.583 0.23 . . . . 0.0 110.915 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -63.68 -46.28 86.25 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.367 0.667 . . . . 0.0 112.277 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.4 pttp -61.82 -41.35 97.67 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.41 -51.68 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.331 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -57.62 -48.61 78.96 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.848 0.859 . . . . 0.0 109.723 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.93 -40.25 95.1 Favored Glycine 0 N--CA 1.451 -0.356 0 O-C-N 123.762 0.664 . . . . 0.0 112.619 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.57 -54.87 40.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.351 0.26 . . . . 0.0 111.146 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.488 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.3 OUTLIER -68.68 -29.68 68.19 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -62.42 -48.49 79.45 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -79.43 -16.63 55.83 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.488 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 38.8 m -84.43 -23.32 30.04 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.23 165.74 12.96 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -107.99 2.73 23.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.584 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 80.5 p -162.75 159.61 24.39 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.33 -35.36 68.58 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.973 -176.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.58 -35.31 78.76 Favored 'General case' 0 C--O 1.209 -1.06 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -65.03 -47.05 78.78 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.717 174.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -43.37 98.48 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -48.74 79.07 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 124.728 1.211 . . . . 0.0 109.512 175.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -64.05 -49.91 70.49 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.291 0.369 . . . . 0.0 111.575 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.13 -30.39 67.56 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.932 -177.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.431 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.43 -42.21 68.53 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.426 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -60.31 -35.0 74.58 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 123.363 0.665 . . . . 0.0 110.338 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.478 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 5.0 mm-40 -66.82 -48.38 69.13 Favored 'General case' 0 C--O 1.26 1.632 0 C-N-CA 123.444 0.698 . . . . 0.0 112.243 175.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.88 -37.61 70.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.904 -0.718 . . . . 0.0 110.914 -178.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.652 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -66.23 -37.75 80.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.538 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 6.8 t80 -52.59 -54.05 38.28 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 125.232 1.413 . . . . 0.0 111.193 174.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -65.46 -32.41 74.0 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.097 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.467 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.6 mp -65.41 -43.59 94.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 CA-C-O 120.624 0.25 . . . . 0.0 110.508 177.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 63.7 mt-30 -63.29 -53.83 46.74 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.102 -175.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -70.07 -28.78 65.71 Favored 'General case' 0 N--CA 1.395 -3.214 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.023 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.7 tp10 -59.77 -51.7 68.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.655 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -63.31 -44.42 95.0 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.979 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.424 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.5 pt-20 -72.05 -40.24 68.51 Favored 'General case' 0 C--O 1.195 -1.808 0 C-N-CA 119.024 -1.071 . . . . 0.0 113.158 -177.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.2 pt-20 -72.8 -32.97 65.94 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 119.497 1.044 . . . . 0.0 111.681 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.28 -29.43 67.32 Favored 'General case' 0 CA--C 1.493 -1.245 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.401 177.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -77.73 -45.43 24.74 Favored 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.135 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.5 ttm-85 -82.91 -59.5 2.47 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 115.384 1.624 . . . . 0.0 115.384 -167.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.3 p -158.33 22.4 0.24 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -165.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -78.42 -21.95 48.47 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 118.215 -1.394 . . . . 0.0 110.177 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 C--O 1.251 1.144 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.575 177.63 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 55.1 m -97.35 -7.66 31.39 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 117.315 0.557 . . . . 0.0 111.315 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.4 ptm -72.33 157.8 36.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 30.9 m -78.27 78.45 4.75 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.487 0.66 . . . . 0.0 110.216 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.896 0.855 . . . . 0.0 108.783 177.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.409 ' HA ' ' OH ' ' A' ' 73' ' ' TYR . 96.0 m-85 -81.03 104.81 11.78 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.207 -1.361 . . . . 0.0 108.614 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -105.2 31.03 8.98 Favored Glycine 0 C--N 1.297 -1.627 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -70.08 -13.5 62.24 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -174.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -67.17 -44.19 80.35 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.5 m -63.26 -38.38 90.92 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.518 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.91 -45.22 75.0 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-O 121.13 0.49 . . . . 0.0 111.168 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -28.67 62.67 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.513 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.31 -48.37 82.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 109.251 175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -57.1 -50.0 74.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.423 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.64 -54.19 48.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.083 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.4 t -65.09 -28.18 69.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.668 0.27 . . . . 0.0 110.913 -176.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.5 m -73.42 -41.59 63.09 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.075 0.464 . . . . 0.0 110.389 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.409 ' HB3' ' NE2' ' A' ' 17' ' ' HIS . 23.3 m-20 -75.97 -58.74 3.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.979 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.582 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 15.8 t -77.88 -55.36 5.38 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -172.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 93.8 mt -74.28 -25.91 59.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -169.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -76.66 -19.0 58.24 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.819 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . 0.473 ' CG ' ' HA3' ' B' ' 126' ' ' GLY . 55.1 m80 -115.26 -63.19 1.49 Allowed 'General case' 0 C--O 1.243 0.746 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 36.6 t 71.67 114.63 0.05 Allowed 'General case' 0 C--O 1.257 1.454 0 C-N-CA 125.621 1.568 . . . . 0.0 110.978 -172.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 20.3 t70 70.52 -70.58 0.15 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.422 1.489 . . . . 0.0 112.15 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -95.43 90.36 1.24 Allowed Glycine 0 N--CA 1.434 -1.498 0 N-CA-C 111.436 -0.665 . . . . 0.0 111.436 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.473 ' HA3' ' CG ' ' B' ' 122' ' ' HIS . . . 162.93 156.68 8.67 Favored Glycine 0 N--CA 1.431 -1.674 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.61 74.89 0.88 Allowed Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 12.8 t -79.19 -168.63 1.55 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 123.122 0.569 . . . . 0.0 110.295 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -80.43 60.42 4.54 Favored Glycine 0 C--O 1.238 0.347 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -86.47 111.47 3.63 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -173.99 147.05 9.08 Favored Glycine 0 N--CA 1.428 -1.854 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 63.2 m -150.75 106.87 3.44 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.153 0.501 . . . . 0.0 110.714 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 166.97 -177.36 41.69 Favored Glycine 0 N--CA 1.433 -1.502 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.88 -172.45 33.93 Favored Glycine 0 C--N 1.304 -1.235 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.149 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.37 -50.79 0.88 Allowed Glycine 0 C--N 1.299 -1.521 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.8 p -131.23 12.06 5.04 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.74 -0.73 . . . . 0.0 110.353 178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.4 mp -95.69 -56.76 2.57 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.826 -176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.536 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -64.61 -42.16 95.73 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.711 178.69 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.21 -37.68 69.98 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 123.865 0.728 . . . . 0.0 110.538 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -82.99 -35.07 26.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.362 0.601 . . . . 0.0 110.22 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.655 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 11.9 tpt -64.19 -27.33 68.99 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.652 1.181 . . . . 0.0 109.774 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.517 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -47.77 -26.47 1.61 Allowed 'General case' 0 C--O 1.193 -1.9 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.7 m -59.41 -60.6 3.6 Favored 'General case' 0 C--O 1.272 2.251 0 CA-C-N 118.756 0.707 . . . . 0.0 111.503 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.586 HD12 ' SD ' ' B' ' 141' ' ' MET . 2.4 pp -73.63 -25.9 21.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 122.246 1.022 . . . . 0.0 110.711 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.528 ' CG2' HD13 ' A' ' 26' ' ' ILE . 7.3 mm -68.72 -33.71 61.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -66.6 -42.77 86.36 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 m -59.78 -26.96 66.14 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.421 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.545 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 22.8 mm-40 -80.64 -62.71 1.59 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.98 -35.2 74.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -169.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.4 tpt -71.87 -55.97 6.57 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 120.439 -0.504 . . . . 0.0 111.313 -175.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -146.78 110.34 4.88 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.239 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 178.399 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.445 0 CA-C-O 120.256 -0.191 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 m -89.33 171.31 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 117.108 0.454 . . . . 0.0 109.871 178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.85 96.31 4.19 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.213 1.006 . . . . 0.0 111.103 179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -91.02 138.15 31.82 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.95 -29.14 8.03 Favored Glycine 0 N--CA 1.478 1.443 0 N-CA-C 115.87 1.108 . . . . 0.0 115.87 -172.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -72.75 -6.08 42.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -62.11 -18.25 60.21 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.28 0.562 . . . . 0.0 111.534 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -90.15 0.2 57.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.468 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.5 m-70 -113.05 4.39 16.65 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.541 0.686 . . . . 0.0 110.454 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.434 HG22 HD13 ' A' ' 14' ' ' LEU . 7.7 p -129.15 125.68 62.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.1 m -96.54 154.05 17.5 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.093 -175.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -40.62 66.4 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 123.185 0.594 . . . . 0.0 111.105 177.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.42 -33.89 74.46 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.517 ' O ' HD23 ' A' ' 18' ' ' LEU . 2.8 tm? -74.4 -51.05 16.13 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -175.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' HG21 ' A' ' 19' ' ' VAL . 8.1 ptm180 -63.21 -43.05 99.23 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.785 -1.098 . . . . 0.0 112.041 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 35.6 t -67.8 -26.15 65.93 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.65 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.671 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 20.6 t60 -71.95 -38.21 69.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.075 177.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -64.45 -35.57 81.36 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.251 175.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 15' ' ' ARG . 98.1 t -56.06 -49.52 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-O 121.529 0.68 . . . . 0.0 109.654 175.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -57.37 -45.15 84.73 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.798 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HD3' ' CD2' ' B' ' 115' ' ' LEU . 20.2 mttp -67.51 -35.55 79.33 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.351 177.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 19' ' ' VAL . 82.3 mt -56.74 -43.92 81.2 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.629 0.372 . . . . 0.0 110.037 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.441 ' HA ' HG22 ' A' ' 26' ' ' ILE . 85.5 t -63.6 -48.38 87.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.321 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -63.49 -25.21 68.15 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.455 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.01 -46.27 16.91 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.292 176.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.441 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.5 tt -70.44 -35.78 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 109.997 -177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -121.82 99.28 44.6 Favored Pre-proline 0 N--CA 1.397 -3.078 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.512 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.11 98.08 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.967 1.778 . . . . 0.0 108.603 171.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -71.2 132.9 85.85 Favored Pre-proline 0 N--CA 1.426 -1.673 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.321 -174.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -72.63 -37.15 4.25 Favored 'Trans proline' 0 C--O 1.217 -0.561 0 C-N-CA 122.524 2.149 . . . . 0.0 111.53 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -140.73 153.46 67.87 Favored Pre-proline 0 CA--C 1.494 -1.175 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.85 -15.54 49.57 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.338 2.025 . . . . 0.0 111.72 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.47 -18.94 54.14 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.314 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.92 -6.11 53.29 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.603 0.716 . . . . 0.0 110.019 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.8 mt -90.76 -0.48 57.72 Favored 'General case' 0 C--O 1.21 -1.018 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.342 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -132.74 20.6 4.21 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.202 1.001 . . . . 0.0 109.213 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.575 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 16.5 t70 -88.5 170.22 11.08 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.407 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.575 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.6 -25.45 68.1 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 122.997 0.519 . . . . 0.0 112.029 -179.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 -75.14 -19.14 60.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 109.723 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.564 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 7.9 tpp -61.46 -46.56 89.52 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.792 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.491 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 12.3 pt-20 -58.85 -29.29 66.84 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 123.263 0.352 . . . . 0.0 110.922 -177.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.401 ' HB2' ' H ' ' B' ' 132' ' ' SER . 6.4 t30 -71.58 -51.74 21.82 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.68 0.752 . . . . 0.0 110.213 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.9 -45.75 84.59 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.103 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.477 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.0 p -73.26 -28.59 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.123 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -58.89 -49.74 76.63 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -56.51 -46.01 80.75 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.893 174.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.88 99.8 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 120.552 0.215 . . . . 0.0 111.187 -178.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.9 mttm -64.48 -48.1 76.47 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.134 0.574 . . . . 0.0 111.313 178.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.619 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.1 pttp -63.58 -40.63 97.44 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-O 121.282 0.563 . . . . 0.0 109.6 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.1 t -64.93 -47.86 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.619 178.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.9 tm-20 -54.16 -49.1 70.03 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 123.744 0.818 . . . . 0.0 109.766 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.22 -43.06 98.84 Favored Glycine 0 C--O 1.236 0.247 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.491 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.54 -52.42 65.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.97 0.508 . . . . 0.0 110.344 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.476 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 1.2 ptp -71.65 -27.92 63.4 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.572 0.952 . . . . 0.0 113.572 179.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -63.1 -49.48 74.29 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -78.38 -17.4 56.51 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.369 0.604 . . . . 0.0 111.864 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 24.7 m -79.97 -19.4 47.99 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.46 166.34 11.57 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -109.87 4.31 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.909 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -161.55 160.79 29.43 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -36.15 74.49 Favored 'General case' 0 C--O 1.191 -2.017 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.584 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.75 -31.59 70.74 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.55 -42.56 64.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.359 -0.213 . . . . 0.0 111.016 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -43.21 96.17 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.4 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -56.27 -48.95 75.55 Favored 'General case' 0 C--O 1.197 -1.668 0 C-N-CA 124.924 1.29 . . . . 0.0 108.857 173.74 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -59.37 -55.55 33.25 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 123.492 0.717 . . . . 0.0 111.09 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.405 HD12 ' CB ' ' A' ' 54' ' ' MET . 3.8 pp -71.17 -29.89 65.76 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.314 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.452 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.66 -39.43 70.31 Favored 'General case' 0 C--N 1.344 0.329 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 176.799 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.486 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.28 -35.84 81.69 Favored 'General case' 0 C--O 1.202 -1.415 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.655 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.4 mm-40 -67.42 -42.87 82.51 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.075 0.55 . . . . 0.0 111.668 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -71.1 -36.55 72.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.654 -179.089 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.654 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -70.49 -38.78 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 19.2 t80 -52.81 -54.3 36.15 Favored 'General case' 0 C--O 1.265 1.883 0 C-N-CA 124.972 1.309 . . . . 0.0 110.997 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -65.26 -38.4 90.19 Favored 'General case' 0 C--O 1.189 -2.081 0 O-C-N 123.823 0.702 . . . . 0.0 110.117 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.15 -40.79 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.465 0.478 . . . . 0.0 110.712 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 60.5 mt-30 -61.98 -54.95 34.59 Favored 'General case' 0 CA--C 1.496 -1.115 0 O-C-N 123.87 0.731 . . . . 0.0 110.596 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -73.21 -27.12 61.44 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.815 -177.111 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.3 tt0 -67.9 -43.57 78.98 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -69.57 -33.66 73.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.291 178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 41.5 mt-10 -63.89 -52.91 57.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.184 176.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.84 -38.8 92.43 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.671 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.542 ' HE3' ' O ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -67.5 -28.72 68.08 Favored 'General case' 0 CA--C 1.505 -0.779 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.239 178.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.418 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 20.9 tpt180 -76.87 -35.14 57.66 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.843 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 6.5 ptp180 -99.7 -43.14 6.57 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 31.0 p -124.57 13.31 8.71 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -171.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.469 ' HD2' ' HB2' ' A' ' 82' ' ' LYS . 9.3 ptm180 -89.28 -28.28 20.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 116.985 -1.886 . . . . 0.0 110.564 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 C--O 1.245 0.841 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 176.351 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.191 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 23.0 t -101.5 16.67 24.93 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 24.3 mmt -86.63 81.16 8.34 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.594 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.3 t -78.04 -38.5 44.41 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 -112.85 143.08 44.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 73.3 t80 74.73 8.33 4.29 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 122.47 1.128 . . . . 0.0 109.639 -175.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -92.24 36.21 3.75 Favored Glycine 0 N--CA 1.44 -1.049 0 O-C-N 121.366 -0.834 . . . . 0.0 113.468 -175.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 36.3 p30 -77.36 -8.91 58.44 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-O 121.452 0.644 . . . . 0.0 111.68 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -50.95 -49.14 60.51 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 125.582 1.553 . . . . 0.0 112.456 177.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.7 t -75.37 -33.38 61.04 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 120.814 0.34 . . . . 0.0 110.329 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 4.2 mm? -64.35 -50.59 67.14 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.955 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -69.94 -33.77 72.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.739 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -62.33 -46.84 86.88 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.789 -0.764 . . . . 0.0 110.424 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 66.4 tp -57.9 -41.8 83.37 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.778 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.531 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 50.6 mt -61.94 -66.14 0.58 Allowed 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.229 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.3 m -52.54 -36.01 54.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.457 0.703 . . . . 0.0 112.24 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 54.5 p -76.72 -55.31 5.61 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.975 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.86 -24.34 52.63 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -174.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.671 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 42.4 p -65.92 -55.29 17.64 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -76.98 -25.15 52.4 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -176.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.5 p -76.13 -51.33 12.42 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.005 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -79.32 -45.42 19.67 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 -178.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 22.9 m 63.91 -172.46 0.17 Allowed 'General case' 0 C--O 1.247 0.924 0 C-N-CA 123.689 0.795 . . . . 0.0 110.561 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 66.45 154.29 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 176.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -161.03 -85.47 0.06 OUTLIER Glycine 0 N--CA 1.428 -1.84 0 N-CA-C 107.896 -2.082 . . . . 0.0 107.896 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.66 -135.76 15.83 Favored Glycine 0 N--CA 1.434 -1.436 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 174.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 98.14 158.53 30.14 Favored Glycine 0 N--CA 1.432 -1.631 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.653 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 1.3 p -87.03 -160.96 0.63 Allowed 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 124.971 1.309 . . . . 0.0 110.739 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -159.77 112.61 0.53 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.072 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -163.12 -152.38 6.8 Favored Glycine 0 C--N 1.319 -0.37 0 C-N-CA 121.071 -0.585 . . . . 0.0 111.919 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -144.0 114.7 0.83 Allowed Glycine 0 C--O 1.24 0.519 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' SER . . . . . 0.401 ' H ' ' HB2' ' A' ' 42' ' ' ASN . 47.6 m -162.51 105.11 1.1 Allowed 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.36 1.064 . . . . 0.0 108.682 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -98.77 174.89 28.4 Favored Glycine 0 C--O 1.244 0.769 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.226 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 116.69 68.61 0.4 Allowed Glycine 0 N--CA 1.435 -1.4 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -77.52 -125.63 0.31 Allowed Glycine 0 N--CA 1.446 -0.696 0 O-C-N 123.557 0.21 . . . . 0.0 113.575 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 43.0 m -156.56 -46.22 0.07 Allowed 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 24.1 tp -105.96 -39.67 5.93 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.35 0.595 . . . . 0.0 111.319 -173.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.542 ' O ' ' HE3' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -54.4 -52.62 61.13 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 125.693 1.597 . . . . 0.0 113.088 -176.673 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 52.2 m 54.31 -95.32 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . 0.418 ' CG ' ' HZ1' ' A' ' 82' ' ' LYS . 4.2 p30 -80.8 -9.86 59.78 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.265 -0.897 . . . . 0.0 111.236 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.635 ' O ' HG12 ' B' ' 145' ' ' ILE . 16.0 tpt -77.45 -27.27 52.08 Favored 'General case' 0 C--O 1.204 -1.313 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 171.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.508 ' HB2' ' HG2' ' B' ' 138' ' ' GLU . 7.1 tt0 -71.59 -25.99 62.41 Favored 'General case' 0 C--O 1.193 -1.88 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.678 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.5 m -55.47 -51.83 65.67 Favored 'General case' 0 C--O 1.266 1.971 0 CA-C-O 121.134 0.492 . . . . 0.0 110.329 175.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.561 HD11 ' SD ' ' B' ' 141' ' ' MET . 43.3 pt -67.0 -32.87 59.96 Favored 'Isoleucine or valine' 0 C--N 1.342 0.249 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.635 HG12 ' O ' ' B' ' 141' ' ' MET . 22.4 mm -65.68 -33.47 63.86 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.82 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.198 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.416 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 58.0 ttp180 -65.27 -43.02 92.58 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 49.3 m -62.41 -37.45 85.85 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.767 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.619 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 12.7 mm-40 -72.82 -43.85 62.18 Favored 'General case' 0 C--O 1.199 -1.575 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 178.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.416 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -68.13 -33.92 75.38 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.362 0.528 . . . . 0.0 110.673 -177.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 21.7 mmt -77.68 -22.48 50.49 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 121.046 0.45 . . . . 0.0 109.867 174.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.91 1.16 3.93 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.638 1.575 . . . . 0.0 111.684 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.8 0 C-N-CA 124.524 1.13 . . . . 0.0 108.178 179.474 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.912 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 m -72.86 142.52 14.99 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.63 97.64 11.3 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 122.273 1.035 . . . . 0.0 109.945 -175.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 mttp -86.58 124.64 33.1 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 113.652 -1.613 . . . . 0.0 107.187 -174.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -51.64 -23.35 9.86 Favored Glycine 0 N--CA 1.478 1.459 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 p-90 -70.48 -12.16 61.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.468 ' CD2' ' HG3' ' A' ' 8' ' ' GLU . 0.3 OUTLIER -64.77 -19.47 65.83 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.049 0.452 . . . . 0.0 111.859 -177.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.468 ' HG3' ' CD2' ' A' ' 7' ' ' HIS . 46.2 mt-10 -90.23 -8.54 50.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.438 0.637 . . . . 0.0 110.117 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -96.89 10.74 38.17 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.89 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.493 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.8 p -138.5 115.01 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.0 m -91.96 154.45 18.81 Favored 'General case' 0 C--N 1.289 -2.039 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.82 -41.62 45.29 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 123.527 0.731 . . . . 0.0 111.047 177.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.52 -41.15 72.73 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.143 0.577 . . . . 0.0 111.535 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.41 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -74.09 -50.47 19.4 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -173.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.465 ' O ' HG22 ' A' ' 19' ' ' VAL . 9.1 ptm180 -65.53 -38.41 89.57 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.026 -177.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -74.01 -22.67 59.5 Favored 'General case' 0 N--CA 1.423 -1.801 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 26.0 t60 -74.15 -35.26 64.05 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 174.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.452 HD23 HD23 ' A' ' 68' ' ' LEU . 3.1 mp -63.9 -38.27 90.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.465 HG22 ' O ' ' A' ' 15' ' ' ARG . 76.3 t -60.89 -46.57 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.465 0.706 . . . . 0.0 109.421 172.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.451 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 23.5 t-80 -53.72 -48.48 69.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.438 176.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -65.21 -39.32 92.64 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.906 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.9 mt -54.65 -48.05 72.79 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.216 0.322 . . . . 0.0 110.417 174.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.25 -48.99 85.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.018 0 O-C-N 123.842 0.714 . . . . 0.0 111.481 174.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' B' ' 132' ' ' SER . 60.1 mt-30 -71.3 -20.58 62.18 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -176.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.36 -46.2 15.02 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.05 176.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.554 HD12 ' CG2' ' B' ' 145' ' ' ILE . 1.7 tt -70.47 -35.15 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-O 122.269 1.033 . . . . 0.0 108.724 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.489 ' HA ' ' HB3' ' B' ' 138' ' ' GLU . 4.9 m-85 -127.87 89.14 51.42 Favored Pre-proline 0 N--CA 1.398 -3.035 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.946 -178.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.41 84.16 0.37 Allowed 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.954 1.769 . . . . 0.0 107.663 171.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 t -52.14 134.58 40.34 Favored Pre-proline 0 N--CA 1.424 -1.735 0 CA-C-N 113.965 -1.47 . . . . 0.0 113.396 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.49 -22.35 21.42 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.203 2.602 . . . . 0.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -157.38 141.57 11.69 Favored Pre-proline 0 CA--C 1.511 -0.555 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -178.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -56.92 -18.09 26.49 Favored 'Trans proline' 0 CA--C 1.549 1.262 0 C-N-CA 122.921 2.414 . . . . 0.0 114.346 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.77 -15.17 57.98 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 121.493 -0.754 . . . . 0.0 112.06 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.39 -9.6 58.86 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.879 0.847 . . . . 0.0 109.463 176.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.8 mt -89.4 1.56 55.66 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 114.704 -1.134 . . . . 0.0 110.494 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -134.89 12.6 3.65 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.389 1.09 . . . . 0.0 109.497 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.581 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 31.7 t70 -87.36 177.65 7.06 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.985 -1.461 . . . . 0.0 110.001 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.581 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -18.08 62.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.435 0.636 . . . . 0.0 110.668 178.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -74.37 -28.02 60.92 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.473 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -64.48 -43.5 93.96 Favored 'General case' 0 C--O 1.193 -1.913 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.479 -176.394 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.437 ' HA ' HG22 ' A' ' 44' ' ' VAL . 7.1 pt-20 -61.58 -29.6 70.13 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.088 0.47 . . . . 0.0 110.966 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -74.61 -44.2 51.82 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.698 176.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.74 -42.38 81.95 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.711 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.533 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 28.4 m -69.83 -35.77 66.54 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.124 0 CA-C-O 119.08 -0.486 . . . . 0.0 110.125 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.97 85.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.41 0.624 . . . . 0.0 109.691 176.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.501 ' CE1' HD11 ' A' ' 26' ' ' ILE . 4.3 t80 -60.69 -47.42 86.36 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.826 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.4 93.97 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.017 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 67.6 mttm -66.3 -44.33 83.77 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.292 0.637 . . . . 0.0 111.443 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.9 pttp -63.46 -41.11 98.62 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.599 0.714 . . . . 0.0 109.602 -179.048 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.0 t -66.29 -51.98 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.022 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.413 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.4 tm-20 -55.76 -47.79 76.4 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.271 1.029 . . . . 0.0 109.846 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.44 -38.62 96.06 Favored Glycine 0 N--CA 1.443 -0.857 0 O-C-N 123.665 0.603 . . . . 0.0 112.717 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -62.03 -51.95 65.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.452 0.644 . . . . 0.0 110.883 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.545 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.2 ptp -72.15 -27.29 62.5 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.929 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -62.54 -53.74 50.2 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.61 -26.45 65.37 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.863 -179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 t -78.87 -22.92 45.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -86.27 163.34 17.78 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.753 0.787 . . . . 0.0 112.847 -176.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -108.12 4.5 24.99 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.112 -178.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.421 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 9.8 p -167.32 154.9 8.97 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.693 0.797 . . . . 0.0 108.949 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.493 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.17 -31.8 66.26 Favored 'General case' 0 C--O 1.194 -1.866 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.616 -175.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.421 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 6.1 p-10 -72.23 -28.54 63.23 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 8.8 tp10 -73.63 -44.21 57.52 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -41.22 98.64 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-O 120.969 0.414 . . . . 0.0 109.94 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.445 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -55.85 -48.52 75.38 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 124.349 1.059 . . . . 0.0 108.293 171.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.526 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.3 t-80 -61.82 -57.91 10.0 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.732 1.213 . . . . 0.0 111.859 -175.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.545 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -66.41 -30.26 70.59 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.479 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -76.11 -34.22 59.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.438 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.472 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -65.11 -31.41 72.6 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 176.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 24.8 mm-40 -65.76 -50.14 65.82 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.954 0.883 . . . . 0.0 109.392 174.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -62.26 -45.24 94.16 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.101 -179.648 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.614 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -68.79 -34.84 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.677 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -176.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.492 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 34.0 t80 -55.63 -54.45 43.97 Favored 'General case' 0 C--O 1.271 2.223 0 C-N-CA 124.515 1.126 . . . . 0.0 110.471 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.3 ptpt -66.83 -32.45 73.73 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.83 -176.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.38 -41.67 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 O-C-N 123.152 0.283 . . . . 0.0 110.5 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.614 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 58.0 mt-30 -62.73 -51.54 66.76 Favored 'General case' 0 CA--C 1.478 -1.805 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.604 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -70.89 -26.81 63.4 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.409 -178.853 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.17 -52.59 64.67 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -64.33 -39.46 93.94 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.968 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.614 ' O ' ' HB3' ' A' ' 84' ' ' ARG . 45.6 mt-10 -59.53 -53.25 60.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 123.555 0.534 . . . . 0.0 111.345 177.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 77' ' ' LYS 0.266 13.1 pt-20 -76.69 -35.51 57.85 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -177.091 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.411 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.74 -37.5 67.69 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 118.976 -1.089 . . . . 0.0 111.8 -178.334 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.501 ' HG3' ' HA ' ' B' ' 137' ' ' LEU . 1.1 tmt_? -78.72 -46.28 19.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.788 0.327 . . . . 0.0 110.522 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.614 ' HB3' ' O ' ' A' ' 80' ' ' GLU . 44.7 ttt180 -96.3 -59.19 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -173.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 56.7 m -151.38 89.83 1.53 Allowed 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -170.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 5.9 ptp180 -138.33 -1.5 1.91 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.551 0.691 . . . . 0.0 109.343 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--O 1.253 1.275 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.289 -177.759 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.14 0 N-CA-C 110.684 -0.967 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -68.63 107.38 2.95 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.171 0.51 . . . . 0.0 110.892 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 15.6 tpt 64.0 92.98 0.06 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.7 1.6 . . . . 0.0 112.365 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 33.2 p -87.03 134.26 33.51 Favored 'General case' 0 N--CA 1.417 -2.109 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -87.32 16.71 5.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.427 0.632 . . . . 0.0 110.782 -176.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -150.26 173.23 14.2 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 125.767 1.627 . . . . 0.0 108.174 173.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.61 -44.9 1.19 Allowed Glycine 0 C--N 1.3 -1.433 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 64.4 12.73 7.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.504 1.522 . . . . 0.0 114.015 169.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -62.02 -49.32 76.51 Favored 'General case' 0 CA--C 1.497 -1.058 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -175.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.584 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 17.6 m -56.02 -44.76 79.03 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.624 0.578 . . . . 0.0 110.782 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.29 -48.96 60.15 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.39 -178.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -66.08 -32.43 73.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.694 -177.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.78 -47.28 84.19 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.95 0.781 . . . . 0.0 109.379 175.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' B' ' 110' ' ' THR . 94.8 mt -56.33 -41.56 76.27 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.778 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.83 -64.9 0.69 Allowed 'General case' 0 C--N 1.347 0.465 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.157 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.445 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 8.9 t -62.48 -33.42 74.81 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -174.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 27.2 p -70.77 -50.89 31.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -76.05 -46.49 28.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 119.136 -1.026 . . . . 0.0 112.308 -177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 9.7 m -59.55 -50.89 72.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -172.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.78 -23.14 58.47 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.7 t -76.57 -33.11 58.5 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -62.67 -47.02 85.5 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.93 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 17.5 m -63.37 -33.7 76.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.353 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.53 86.05 2.23 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-O 120.769 0.318 . . . . 0.0 110.528 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 134.86 -57.97 0.69 Allowed Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 108.56 -101.5 1.57 Allowed Glycine 0 N--CA 1.426 -1.992 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.114 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -159.1 51.14 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.6 p -129.6 97.8 4.64 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -78.97 57.15 4.33 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-N 116.203 -0.453 . . . . 0.0 112.994 -177.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -95.38 57.19 1.69 Allowed Glycine 0 N--CA 1.436 -1.324 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -178.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -87.97 44.5 3.23 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 112.319 -0.312 . . . . 0.0 112.319 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' SER . . . . . 0.414 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 29.3 t -168.81 162.09 11.32 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 164.22 -179.68 38.94 Favored Glycine 0 N--CA 1.426 -1.988 0 N-CA-C 107.434 -2.266 . . . . 0.0 107.434 -178.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 156.51 -89.71 0.12 Allowed Glycine 0 C--N 1.298 -1.554 0 C-N-CA 119.327 -1.416 . . . . 0.0 112.583 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 148.3 -127.79 2.66 Favored Glycine 0 N--CA 1.425 -2.097 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.668 -177.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 17.0 p -72.99 47.93 0.2 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.501 ' HA ' ' HG3' ' A' ' 83' ' ' ARG . 5.6 mp -105.15 -26.85 11.91 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 121.428 -0.795 . . . . 0.0 110.258 175.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.489 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.1 -47.79 60.34 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.601 -1.181 . . . . 0.0 113.922 -175.202 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 78.0 m -61.9 -21.02 64.37 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.83 -32.67 25.16 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 121.238 0.542 . . . . 0.0 109.992 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 10.4 ttm -81.3 -18.58 45.33 Favored 'General case' 0 C--O 1.257 1.471 0 C-N-CA 123.358 0.663 . . . . 0.0 111.857 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.511 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 32.8 mt-10 -48.89 -27.5 3.12 Favored 'General case' 0 C--O 1.191 -1.992 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -178.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 1.6 m -57.62 -59.61 4.93 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 119.415 1.007 . . . . 0.0 109.881 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.06 -24.24 24.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.748 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.554 ' CG2' HD12 ' A' ' 26' ' ' ILE . 9.4 mm -72.0 -45.65 62.82 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.389 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.755 175.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.482 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 96.8 mtt180 -63.69 -35.9 82.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 117.833 0.288 . . . . 0.0 110.902 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.1 m -62.12 -50.66 71.02 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.874 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.73 -40.7 98.03 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.474 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.482 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -75.67 -22.75 56.44 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.64 -0.663 . . . . 0.0 112.492 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 41.3 tpp -69.62 -26.18 64.31 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 173.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 19.5 t70 71.81 17.44 5.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.723 1.609 . . . . 0.0 111.471 172.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.323 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.686 179.754 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.135 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 39.0 t 62.5 84.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 0.0 111.482 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.36 22.16 5.61 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.263 177.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.4 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.8 pttp -55.88 102.79 0.08 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.104 172.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.77 -24.63 4.31 Favored Glycine 0 N--CA 1.47 0.914 0 C-N-CA 125.603 1.573 . . . . 0.0 116.964 -168.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.4 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 68.5 p-90 -62.59 -16.87 58.56 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -12.59 54.24 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.987 0.423 . . . . 0.0 112.072 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.78 -26.01 34.81 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 109.818 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -90.87 2.75 55.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.687 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.6 110.52 11.42 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-O 121.535 0.683 . . . . 0.0 109.501 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.43 171.12 8.9 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.991 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.47 -43.57 68.26 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 124.298 0.999 . . . . 0.0 110.807 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -52.53 -44.23 65.62 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.589 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -75.72 -47.54 25.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -172.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.465 ' O ' HG21 ' A' ' 19' ' ' VAL . 10.0 ptm180 -65.68 -44.72 85.36 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.486 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -68.93 -23.12 64.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 121.261 0.553 . . . . 0.0 109.545 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.659 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 34.3 t60 -68.38 -44.75 74.48 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 174.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.589 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.7 OUTLIER -63.12 -37.66 88.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 119.217 -0.993 . . . . 0.0 109.725 176.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 15' ' ' ARG . 84.6 t -54.27 -46.74 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.586 0.554 . . . . 0.0 109.781 175.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.506 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 53.9 t-80 -61.05 -41.59 96.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.048 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.485 ' HE2' ' OE1' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -73.26 -31.34 64.03 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.167 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 19' ' ' VAL . 88.0 mt -56.9 -42.51 80.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 173.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 24.0 t -59.36 -53.53 46.91 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.848 172.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 46.3 mt-30 -61.76 -26.34 68.02 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.439 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . . . -81.65 -46.99 13.56 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.562 177.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.554 HD13 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -71.86 -29.65 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 122.111 0.957 . . . . 0.0 109.943 -177.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.447 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 79.7 t80 -130.23 83.43 63.02 Favored Pre-proline 0 N--CA 1.4 -2.954 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.306 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.48 84.03 0.13 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.58 2.186 . . . . 0.0 107.959 170.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.415 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 12.0 t -58.35 142.62 81.41 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.401 -171.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.11 -30.93 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.345 2.03 . . . . 0.0 110.57 174.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -146.12 139.77 14.87 Favored Pre-proline 0 CA--C 1.506 -0.75 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 -175.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -54.46 -22.13 26.41 Favored 'Trans proline' 0 CA--C 1.563 1.935 0 C-N-CA 122.668 2.245 . . . . 0.0 114.168 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.68 -10.0 59.72 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 121.199 -0.938 . . . . 0.0 112.105 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.415 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -80.39 -7.94 59.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 109.694 176.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 40' ' ' MET . 35.6 mt -86.93 2.73 48.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.225 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -133.12 16.12 4.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.544 0.688 . . . . 0.0 109.467 178.198 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 40' ' ' MET . 24.3 t70 -81.48 176.98 9.23 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.037 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.512 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.67 -22.78 62.44 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.918 -0.488 . . . . 0.0 111.725 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -73.1 -22.03 60.64 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.61 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.2 tpp -61.3 -45.61 93.74 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.838 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -59.62 -30.72 68.9 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.766 -0.773 . . . . 0.0 111.155 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -72.34 -46.05 57.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.068 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.13 -42.11 76.46 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.478 -178.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.61 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.7 p -73.26 -30.84 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.573 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.68 91.97 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.505 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -59.67 -48.36 81.96 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.272 175.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.32 97.17 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 120.617 0.246 . . . . 0.0 110.964 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -65.11 -45.4 85.28 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.5 pttp -62.47 -40.98 98.41 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.0 t -65.07 -52.78 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.991 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.214 179.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.401 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.1 tm-20 -57.65 -48.28 79.93 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.906 0.883 . . . . 0.0 109.652 -178.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.62 -40.52 94.78 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.963 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.28 -54.28 47.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.401 0.619 . . . . 0.0 110.5 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.482 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.5 ptp -68.75 -30.05 68.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -66.84 -38.41 86.33 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.831 0.824 . . . . 0.0 108.936 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -82.48 -25.62 33.36 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.868 -1.145 . . . . 0.0 112.648 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -82.93 -26.65 31.22 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 120.907 0.384 . . . . 0.0 111.898 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.72 155.76 25.36 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -175.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -102.33 -0.29 32.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.097 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 p -156.9 159.3 38.01 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.11 -27.61 62.75 Favored 'General case' 0 C--O 1.17 -3.12 0 C-N-CA 118.288 -1.365 . . . . 0.0 109.504 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.85 -40.35 87.88 Favored 'General case' 0 C--O 1.209 -1.037 0 O-C-N 123.625 0.578 . . . . 0.0 109.501 178.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.8 -45.52 85.91 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.82 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -47.55 82.61 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.449 ' HD1' ' N ' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -51.2 -48.63 61.94 Favored 'General case' 0 C--O 1.21 -0.988 0 C-N-CA 125.892 1.677 . . . . 0.0 109.756 174.055 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.486 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 28.7 t-80 -74.15 -49.39 23.9 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.676 -169.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.73 -29.46 68.7 Favored 'General case' 0 C--O 1.249 1.065 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.502 -178.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.482 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.4 OUTLIER -73.22 -40.03 65.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.171 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.485 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.1 -34.5 75.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 123.381 0.425 . . . . 0.0 109.93 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 7.4 mm-40 -63.68 -46.28 86.28 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.362 0.665 . . . . 0.0 111.005 175.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.32 -36.97 69.02 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.345 -0.942 . . . . 0.0 112.108 -178.163 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.584 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -67.03 -38.75 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.505 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.96 -54.51 37.94 Favored 'General case' 0 C--O 1.254 1.329 0 C-N-CA 124.824 1.25 . . . . 0.0 111.271 175.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 16.9 ptpt -66.04 -33.84 76.72 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.461 -175.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.71 -44.31 96.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 123.439 0.462 . . . . 0.0 111.103 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.2 mt-30 -61.27 -50.75 71.74 Favored 'General case' 0 CA--C 1.49 -1.341 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -176.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.613 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -73.62 -29.17 62.2 Favored 'General case' 0 N--CA 1.395 -3.221 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.961 -177.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 28.4 tt0 -62.61 -52.62 62.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.834 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 3.9 pp -60.61 -45.45 93.96 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 123.818 0.699 . . . . 0.0 110.813 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.412 ' CD ' HH21 ' A' ' 84' ' ' ARG . 7.8 tp10 -59.55 -53.72 54.83 Favored 'General case' 0 N--CA 1.401 -2.923 0 O-C-N 123.898 0.749 . . . . 0.0 111.29 -178.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.1 pt-20 -71.92 -34.27 68.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 119.769 -0.772 . . . . 0.0 113.043 -176.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.507 ' HB2' ' HZ3' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -75.5 -41.04 56.3 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.482 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.09 -41.66 61.34 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -176.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.412 HH21 ' CD ' ' A' ' 80' ' ' GLU . 13.1 ttm180 -67.62 -38.12 83.46 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 175.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 54.7 m 84.12 84.69 0.03 OUTLIER 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 113.59 -1.641 . . . . 0.0 112.642 174.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -71.2 -27.04 63.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 78.3 mt . . . . . 0 C--O 1.245 0.824 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.485 -178.628 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.764 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 22.9 t -91.83 114.15 26.61 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.3 mmt -80.96 81.96 7.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.138 0.494 . . . . 0.0 110.28 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.0 t -154.62 148.15 25.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -137.58 176.28 8.84 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -118.49 176.34 5.3 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 174.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.97 -48.3 4.03 Favored Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.776 -176.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 41.5 p-10 -71.33 -8.59 54.72 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 125.245 1.418 . . . . 0.0 110.42 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -58.75 -51.81 68.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.795 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 47.4 m -58.75 -39.0 79.67 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.846 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.49 -54.9 21.62 Favored 'General case' 0 C--O 1.247 0.957 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.949 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 0.0 OUTLIER -73.07 -25.14 60.8 Favored 'General case' 0 C--O 1.247 0.971 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.574 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -60.1 -51.27 70.34 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.88 -45.61 86.11 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.935 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.12 -61.51 2.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.471 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.5 m -60.21 -40.61 90.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.424 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.554 ' O ' ' HB3' ' B' ' 121' ' ' SER . 60.7 p -77.39 -35.12 54.64 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.039 -174.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.1 -49.86 32.87 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.624 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.659 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 37.9 t -70.39 -55.02 10.1 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -177.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.61 -46.99 13.61 Favored 'General case' 0 N--CA 1.426 -1.645 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.628 -172.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' B' ' 117' ' ' SER . 22.6 t -76.78 -41.98 42.55 Favored 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -176.317 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -89.77 -72.82 0.54 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 118.357 -1.337 . . . . 0.0 111.689 -177.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 75.5 m 171.77 -165.53 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.267 1.827 . . . . 0.0 106.122 -173.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.16 75.19 5.71 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.039 0.923 . . . . 0.0 109.75 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 99.92 110.79 3.21 Favored Glycine 0 N--CA 1.432 -1.592 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -57.19 155.72 16.38 Favored Glycine 0 C--O 1.246 0.886 0 CA-C-N 116.635 0.217 . . . . 0.0 113.613 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -64.91 -38.93 96.12 Favored Glycine 0 C--O 1.225 -0.462 0 N-CA-C 114.158 0.423 . . . . 0.0 114.158 -176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.2 m -76.03 -12.35 60.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.506 0.67 . . . . 0.0 110.576 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 135.78 104.72 0.77 Allowed Glycine 0 N--CA 1.418 -2.542 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -76.06 68.72 2.27 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 127.39 -167.73 19.68 Favored Glycine 0 N--CA 1.422 -2.245 0 N-CA-C 109.706 -1.358 . . . . 0.0 109.706 -176.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 13.3 t -143.05 146.76 34.12 Favored 'General case' 0 N--CA 1.426 -1.659 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -104.65 -144.81 13.35 Favored Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.93 -70.17 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.286 -0.959 . . . . 0.0 112.057 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 142.06 -113.91 0.85 Allowed Glycine 0 N--CA 1.424 -2.106 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.714 -177.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -92.59 31.09 1.4 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.74 -16.94 49.5 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.692 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.447 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.63 -24.6 49.51 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.555 0.693 . . . . 0.0 111.219 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 43.3 t -53.73 144.43 18.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.873 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 77.21 -33.78 0.2 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.215 1.006 . . . . 0.0 112.953 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.834 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 15.3 ttt -80.88 -27.02 36.46 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.533 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.6 mt-10 -48.57 -27.99 3.14 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -178.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.0 p -56.93 -59.7 4.66 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 121.671 0.748 . . . . 0.0 111.485 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.19 -24.3 24.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.406 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.554 ' CG2' HD13 ' A' ' 26' ' ' ILE . 14.8 mm -63.43 -46.45 95.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.79 173.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -59.85 -42.61 94.03 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 123.994 0.809 . . . . 0.0 109.19 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.5 m -66.33 -34.07 77.14 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.762 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -47.33 22.99 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.44 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.1 pp -66.94 -25.25 66.26 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 50.5 tpp -58.32 -45.66 87.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 175.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.6 t70 67.84 -57.13 0.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 112.851 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.294 -1.82 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.956 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 114.176 0.43 . . . . 0.0 114.176 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -67.18 -19.24 65.54 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -71.32 -10.21 59.38 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 119.765 -0.774 . . . . 0.0 113.017 -175.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -83.69 -7.12 59.55 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.762 0.791 . . . . 0.0 109.185 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -99.81 7.14 45.23 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.001 -177.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.8 p -139.54 114.67 7.96 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.526 0.679 . . . . 0.0 109.348 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.1 166.28 13.5 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -49.13 -41.61 36.69 Favored 'General case' 0 C--O 1.206 -1.224 0 C-N-CA 124.351 1.061 . . . . 0.0 111.154 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -52.06 -47.07 65.3 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.203 0.601 . . . . 0.0 111.925 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.414 HD13 HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.05 -45.83 59.32 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.3 ptm180 -70.07 -42.58 72.6 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.752 -177.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.9 t -67.89 -26.74 66.15 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.602 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 8.7 t60 -70.7 -43.35 69.18 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 176.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.657 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -65.36 -37.91 88.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.478 176.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -57.05 -45.43 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 173.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 12.2 t-80 -57.98 -44.97 87.41 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.58 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.1 mptp? -64.36 -38.17 90.09 Favored 'General case' 0 CA--C 1.506 -0.713 0 C-N-CA 119.977 -0.689 . . . . 0.0 112.635 177.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.4 mt -54.75 -44.92 74.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 123.381 0.426 . . . . 0.0 109.88 176.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.433 ' HA ' HG22 ' A' ' 26' ' ' ILE . 54.0 t -63.83 -48.4 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.812 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 35.4 mt-30 -60.25 -27.96 67.66 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 120.954 0.407 . . . . 0.0 111.906 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.583 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.21 -46.58 14.61 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.772 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.544 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.7 tt -71.35 -30.18 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.699 0.762 . . . . 0.0 110.12 -176.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.454 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 70.9 t80 -127.89 103.87 21.14 Favored Pre-proline 0 N--CA 1.409 -2.494 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.341 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.454 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 57.1 Cg_endo -67.57 76.5 0.54 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.848 2.365 . . . . 0.0 110.463 175.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 13.0 t -60.46 126.42 84.56 Favored Pre-proline 0 N--CA 1.423 -1.807 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.976 -175.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -73.18 -29.91 11.1 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.341 2.027 . . . . 0.0 111.574 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -146.9 143.87 19.12 Favored Pre-proline 0 C--N 1.308 -1.233 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.416 ' HA ' HD12 ' A' ' 35' ' ' LEU . 6.9 Cg_endo -53.74 -18.28 11.93 Favored 'Trans proline' 0 CA--C 1.557 1.634 0 C-N-CA 122.652 2.235 . . . . 0.0 114.05 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.56 -13.41 59.55 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.566 -0.709 . . . . 0.0 112.469 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.448 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -78.36 -6.53 55.43 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.452 1.12 . . . . 0.0 108.747 175.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.462 ' HA ' ' HE2' ' A' ' 40' ' ' MET . 21.8 mt -89.97 7.75 35.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.383 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.72 18.55 4.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.817 0.818 . . . . 0.0 109.323 173.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.598 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 20.5 t70 -80.79 173.78 12.27 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.477 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.598 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -65.5 -24.98 67.27 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 121.955 -0.465 . . . . 0.0 110.901 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 33.1 ttm180 -74.9 -22.35 58.68 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.739 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.0 tpp -59.4 -45.22 92.1 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.732 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -56.3 -36.09 68.27 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.199 0.524 . . . . 0.0 109.866 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -76.15 -43.87 40.86 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.377 1.071 . . . . 0.0 111.372 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 78.6 mt -70.04 -40.86 74.87 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.696 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.739 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.32 -30.7 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.896 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -61.21 -49.17 78.21 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 174.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.61 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 6.8 t80 -57.96 -44.44 87.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.674 0.79 . . . . 0.0 110.215 174.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.64 87.87 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.636 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -68.82 -40.3 79.57 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 1.4 ptmt -65.44 -41.74 93.16 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.359 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.7 t -65.5 -52.7 48.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.629 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -57.78 -51.28 70.21 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.648 0.779 . . . . 0.0 110.015 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -39.18 93.33 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 123.495 0.497 . . . . 0.0 112.941 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.96 -51.63 68.46 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.442 0.639 . . . . 0.0 110.91 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 2.3 ptp -73.59 -27.59 61.38 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.321 -0.854 . . . . 0.0 113.272 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -62.03 -47.39 84.94 Favored 'General case' 0 C--O 1.2 -1.503 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -74.04 -22.62 59.49 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 t -77.54 -32.26 53.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.96 169.46 11.52 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -120.29 17.61 12.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.911 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.7 p -167.88 151.11 5.92 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.55 -33.34 73.91 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.185 -177.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -65.65 -36.96 85.19 Favored 'General case' 0 C--O 1.198 -1.615 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.285 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 9.4 tp10 -67.84 -46.45 71.76 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.63 99.25 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.762 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -48.72 78.9 Favored 'General case' 0 C--O 1.206 -1.22 0 C-N-CA 123.766 0.826 . . . . 0.0 109.054 172.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.417 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 39.5 m-70 -61.23 -55.91 26.62 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.6 pp -64.9 -29.65 70.6 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 18' ' ' LEU . 0.3 OUTLIER -76.04 -39.19 56.09 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.434 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.522 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.8 -29.12 69.94 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 123.02 0.528 . . . . 0.0 109.642 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 72.7 mm-40 -67.81 -53.04 30.11 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.291 0.637 . . . . 0.0 111.656 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.42 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -66.16 -35.65 81.03 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 119.338 -0.945 . . . . 0.0 111.46 -177.732 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.567 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.99 -40.24 80.69 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.8 t80 -52.29 -54.56 29.85 Favored 'General case' 0 C--O 1.257 1.489 0 C-N-CA 125.047 1.339 . . . . 0.0 111.416 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 74' ' ' LYS . 16.1 ptpt -67.86 -35.46 78.59 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.017 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -62.39 -39.69 85.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 O-C-N 123.424 0.453 . . . . 0.0 110.83 177.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.583 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 46.6 mt-30 -64.36 -55.62 19.88 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 123.518 0.511 . . . . 0.0 110.822 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.3 ptpt -68.0 -28.66 67.61 Favored 'General case' 0 N--CA 1.417 -2.084 0 C-N-CA 119.632 -0.827 . . . . 0.0 112.459 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 82' ' ' LYS . 13.5 tp10 -58.57 -53.16 61.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 123.639 0.587 . . . . 0.0 109.833 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -67.34 -38.94 85.65 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 123.199 0.312 . . . . 0.0 111.708 -177.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -62.73 -53.16 58.6 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.541 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.7 pt-20 -72.06 -34.32 68.65 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 120.174 -0.61 . . . . 0.0 112.307 -176.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.498 -1.034 0 C-N-CA 119.594 -0.843 . . . . 0.0 111.609 -178.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.442 -0.835 0 CA-C-O 121.067 0.46 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -72.95 -39.97 65.77 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.314 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' GLN . . . . . 0.417 HE22 ' HB3' ' A' ' 69' ' ' ALA . 84.9 mm-40 -63.49 -43.22 97.88 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.066 0.46 . . . . 0.0 111.076 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -66.89 -36.74 82.98 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 122.721 0.408 . . . . 0.0 110.77 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 61.6 tp -56.57 -53.85 52.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.43 -45.73 90.72 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.954 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.6 m -57.02 -36.14 70.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.985 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 38.5 m -77.27 -58.42 3.28 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.231 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.32 -60.12 4.36 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 C--N 1.308 -1.224 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.664 -171.469 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.609 ' O ' HG12 ' B' ' 145' ' ' ILE . 14.3 tpt . . . . . 0 C--O 1.208 -1.092 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 38.5 mt-10 -58.85 -27.28 64.99 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 24.8 t -61.57 -54.29 45.05 Favored 'General case' 0 C--O 1.249 1.066 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.543 HD11 ' SD ' ' B' ' 141' ' ' MET . 49.3 pt -66.01 -29.26 46.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.609 HG12 ' O ' ' B' ' 141' ' ' MET . 14.2 mm -64.16 -43.39 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.813 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 20.7 mtm180 -59.1 -42.51 90.65 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 48.3 m -59.94 -41.65 92.28 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.517 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 144' ' ' ILE . 28.9 mt-10 -77.2 -38.42 51.52 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.888 -0.508 . . . . 0.0 112.358 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.55 HD23 HG22 ' B' ' 145' ' ' ILE . 4.4 pp -75.36 -24.87 57.33 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 58.5 ttp . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -176.886 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.307 0 N-CA-C 116.081 1.193 . . . . 0.0 116.081 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 p-90 -74.03 -7.09 51.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.06 0.93 . . . . 0.0 111.079 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -55.28 -25.03 31.4 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -87.26 0.24 55.68 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.431 0.634 . . . . 0.0 111.725 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -106.7 7.05 30.27 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.711 0.767 . . . . 0.0 109.907 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.99 110.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.698 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.442 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -91.05 160.03 15.81 Favored 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -176.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.97 -38.36 67.69 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.127 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.38 -39.16 85.62 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 120.901 0.381 . . . . 0.0 111.489 -177.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.08 -48.75 61.87 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -68.3 -38.99 82.17 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.738 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.9 t -65.15 -29.85 70.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.766 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 66.2 t60 -69.64 -42.63 74.02 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.46 176.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.593 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -60.88 -38.68 86.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.164 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 97.9 t -59.08 -51.04 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 121.296 0.569 . . . . 0.0 109.673 174.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -51.29 -47.88 62.44 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.576 1.15 . . . . 0.0 110.605 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.766 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 54.7 mttm -67.99 -37.86 81.98 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 86.9 mt -54.7 -42.88 72.01 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.69 -52.05 65.42 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.938 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.336 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -74.1 -14.51 60.99 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.711 -0.796 . . . . 0.0 112.936 -175.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.27 -46.27 15.02 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.757 173.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 5.0 tt -72.72 -28.93 28.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.618 0.723 . . . . 0.0 109.866 -177.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -132.59 92.57 26.95 Favored Pre-proline 0 N--CA 1.401 -2.894 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.216 -175.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.74 91.93 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.423 2.082 . . . . 0.0 107.928 170.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.5 123.23 78.12 Favored Pre-proline 0 N--CA 1.422 -1.872 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.893 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.03 -23.44 12.16 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.115 2.543 . . . . 0.0 111.683 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -143.87 143.04 21.62 Favored Pre-proline 0 CA--C 1.491 -1.302 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.28 -13.64 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 121.496 1.464 . . . . 0.0 110.697 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.32 -14.18 55.76 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.754 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.83 -12.14 60.31 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 122.047 0.927 . . . . 0.0 109.325 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 26.1 mt -83.98 0.61 47.32 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.464 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -133.18 19.01 4.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.91 0.862 . . . . 0.0 109.572 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.493 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.9 t70 -77.37 174.68 10.53 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.692 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.482 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -69.79 -27.41 64.88 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.327 0.585 . . . . 0.0 109.61 176.759 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 14.7 ttm180 -73.48 -21.3 60.46 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.297 0.57 . . . . 0.0 110.053 177.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.532 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -61.28 -40.34 93.74 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.491 177.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.0 pt-20 -62.56 -30.76 71.54 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 118.62 -1.232 . . . . 0.0 109.896 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -70.69 -48.5 54.39 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.71 1.204 . . . . 0.0 110.527 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.7 mt -67.92 -44.78 76.08 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.833 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.532 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.5 p -72.18 -32.34 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.414 -0.515 . . . . 0.0 109.93 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.62 -41.51 99.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.498 0.666 . . . . 0.0 109.319 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -60.56 -50.31 74.03 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.618 173.156 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.84 -40.57 88.96 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.989 0.423 . . . . 0.0 110.964 -177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.8 mttt -65.03 -48.27 74.46 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.301 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 15.0 pttp -63.8 -38.46 91.19 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 46' ' ' TYR . 55.2 t -64.43 -53.3 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.204 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -56.05 -46.81 78.79 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 124.09 0.869 . . . . 0.0 109.696 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.15 99.72 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.646 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -58.07 -53.27 60.1 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 123.292 0.637 . . . . 0.0 110.828 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.3 -32.92 74.22 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 178.911 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -64.66 -41.99 95.72 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 123.328 0.651 . . . . 0.0 109.56 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.43 -22.09 41.53 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.011 -0.431 . . . . 0.0 111.995 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.1 t -79.14 -54.18 6.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 160.08 14.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -171.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -102.59 -2.1 29.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.588 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.3 m -154.82 160.23 41.11 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.26 -36.9 69.15 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 118.799 -1.16 . . . . 0.0 111.753 -179.705 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.46 -38.14 83.22 Favored 'General case' 0 C--O 1.197 -1.66 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -47.09 77.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.299 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.09 91.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.53 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.1 OUTLIER -55.98 -48.67 75.41 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 125.66 1.584 . . . . 0.0 109.12 175.167 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -61.25 -55.56 30.54 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 123.842 0.857 . . . . 0.0 111.851 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.56 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.9 pp -68.61 -29.3 67.79 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 120.469 -0.493 . . . . 0.0 111.336 -175.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.593 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.76 -40.94 69.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.516 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.13 -38.07 78.77 Favored 'General case' 0 C--O 1.203 -1.363 0 C-N-CA 123.463 0.705 . . . . 0.0 109.699 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 4.8 mm-40 -60.94 -50.08 74.87 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.188 0.995 . . . . 0.0 111.825 175.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.429 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.77 -35.95 67.55 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 119.222 -0.991 . . . . 0.0 111.642 -177.515 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.65 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -67.93 -36.96 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.7 -54.23 40.87 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 124.976 1.311 . . . . 0.0 110.985 175.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -32.29 72.01 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.195 -176.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -64.06 -43.8 97.61 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 59.8 mt-30 -63.17 -51.62 65.67 Favored 'General case' 0 CA--C 1.493 -1.241 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.903 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.1 ptpt -72.16 -27.61 62.7 Favored 'General case' 0 N--CA 1.402 -2.852 0 C-N-CA 119.048 -1.061 . . . . 0.0 112.911 -177.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -60.72 -52.87 63.26 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.1 pp -65.38 -35.67 81.67 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.97 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.75 -44.54 73.53 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -71.19 -34.77 71.21 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 121.973 -0.454 . . . . 0.0 111.479 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HB2' ' NZ ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.597 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.354 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.437 -1.094 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.36 -40.13 74.21 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.845 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -61.87 -36.87 82.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.742 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -61.84 -46.88 87.57 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.734 0.646 . . . . 0.0 109.731 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.71 -47.2 74.01 Favored 'General case' 0 C--O 1.249 1.042 0 O-C-N 123.751 0.657 . . . . 0.0 110.081 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.497 HD23 ' CD ' ' A' ' 21' ' ' LYS . 85.8 mt -52.87 -62.05 1.9 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.532 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.53 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 7.3 t -69.08 -25.79 64.61 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.627 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -71.39 -52.12 20.32 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.406 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.536 ' HB2' ' NE2' ' A' ' 17' ' ' HIS . 54.1 m-20 -75.72 -31.97 59.86 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.676 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 47.0 p . . . . . 0 C--N 1.321 -0.665 0 C-N-CA 120.058 -0.657 . . . . 0.0 111.894 -177.692 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.5 ttt . . . . . 0 N--CA 1.431 -1.422 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.7 mt-10 -57.1 -27.9 62.18 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.2 m -67.39 -46.77 72.3 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 120.791 0.329 . . . . 0.0 110.417 178.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.446 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.8 pp -73.16 -27.73 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.726 0.774 . . . . 0.0 109.853 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 8.9 mm -66.77 -44.44 89.3 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.854 174.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.562 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 23.7 ttt180 -64.66 -37.32 87.16 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.367 0.417 . . . . 0.0 110.121 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 11.4 t -63.61 -43.68 96.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.75 -51.36 65.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.179 0.591 . . . . 0.0 111.65 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.576 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.4 pp -66.85 -24.52 66.15 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -176.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 C--O 1.243 0.734 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.866 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 C--O 1.218 -0.852 0 N-CA-C 115.291 0.876 . . . . 0.0 115.291 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.9 p-90 -77.49 -4.21 44.43 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 122.119 -0.636 . . . . 0.0 110.851 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -59.8 -18.09 40.94 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.267 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 11.4 pt-20 -90.32 -10.84 42.61 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.065 0.46 . . . . 0.0 111.059 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 64.6 m-70 -99.93 6.13 45.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.466 0.651 . . . . 0.0 110.575 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.455 HG23 HD12 ' A' ' 14' ' ' LEU . 6.1 p -127.76 110.64 22.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-N 114.913 -1.039 . . . . 0.0 108.304 177.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 m -74.94 150.16 39.16 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.121 -175.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 1.3 tm0? -58.59 -38.36 77.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.305 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 16.6 m-20 -67.29 -35.62 79.85 Favored 'General case' 0 C--O 1.197 -1.706 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.56 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.455 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -67.6 -50.04 60.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -63.23 -42.01 99.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.831 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.6 t -69.47 -30.35 68.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.666 0.746 . . . . 0.0 110.235 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.616 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 12.7 t60 -75.0 -35.44 62.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.378 -178.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 HD21 ' A' ' 68' ' ' LEU . 1.6 mp -65.63 -37.76 87.46 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 174.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.5 t -57.29 -46.02 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.6 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.0 t-80 -55.96 -47.96 76.69 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.824 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.616 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 3.4 mptp? -64.14 -37.66 88.25 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 178.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 26' ' ' ILE . 91.9 mt -53.53 -47.24 70.14 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.9 t -58.84 -50.85 77.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.218 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.2 mt-30 -60.46 -32.67 71.62 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.46 -43.34 19.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.526 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.55 -30.48 42.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 122.078 0.942 . . . . 0.0 109.552 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -127.95 86.26 58.6 Favored Pre-proline 0 N--CA 1.402 -2.873 0 CA-C-N 114.371 -1.286 . . . . 0.0 108.547 -178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.12 78.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.11 2.54 . . . . 0.0 109.678 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 t -59.28 136.94 88.62 Favored Pre-proline 0 N--CA 1.419 -2.0 0 CA-C-N 114.387 -1.278 . . . . 0.0 113.093 -173.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -75.66 -19.35 16.59 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.774 2.316 . . . . 0.0 111.513 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -160.89 142.61 9.06 Favored Pre-proline 0 CA--C 1.51 -0.594 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -53.41 -21.18 17.36 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 C-N-CA 122.884 2.389 . . . . 0.0 114.352 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.72 60.01 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 121.295 -0.878 . . . . 0.0 112.885 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.19 56.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.023 0.916 . . . . 0.0 109.209 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 40' ' ' MET . 19.4 mt -89.69 7.11 38.38 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.999 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -132.76 19.02 4.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.745 0.783 . . . . 0.0 109.373 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.604 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.8 t70 -82.84 175.51 10.03 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.295 -178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.62 -25.91 62.35 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.901 -0.499 . . . . 0.0 111.008 177.543 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.6 ttp180 -69.74 -21.44 63.46 Favored 'General case' 0 C--O 1.251 1.144 0 CA-C-O 121.79 0.805 . . . . 0.0 109.597 175.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.682 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.8 tpp -63.03 -41.36 99.51 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.345 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -59.57 -31.66 69.65 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.713 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.474 HD21 HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -75.38 -45.84 36.67 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.004 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.39 -42.53 92.56 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.334 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.682 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.1 p -73.4 -31.15 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.01 -48.4 81.85 Favored 'General case' 0 C--N 1.35 0.588 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -58.92 -46.65 87.43 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.322 175.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.23 94.52 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.07 0.231 . . . . 0.0 110.892 -178.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -62.45 -47.64 83.14 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 16.3 pttp -65.44 -35.58 81.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.109 0.48 . . . . 0.0 110.412 -177.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.772 ' O ' ' HG2' ' A' ' 54' ' ' MET . 42.8 t -70.71 -51.06 39.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.759 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -57.23 -45.51 83.83 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.352 0.661 . . . . 0.0 110.189 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.34 -38.27 96.16 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.874 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HB3' ' HE3' ' A' ' 54' ' ' MET . 21.4 t70 -58.13 -50.8 72.22 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.772 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.7 OUTLIER -65.98 -43.24 88.44 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.931 -175.11 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -56.59 -42.07 78.07 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.874 0.869 . . . . 0.0 108.774 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -83.2 -13.71 54.84 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.9 m -90.0 -24.76 21.15 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.642 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.99 164.48 11.79 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.586 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -125.22 19.08 8.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 m -158.78 153.85 25.25 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.437 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.56 -39.45 67.43 Favored 'General case' 0 C--O 1.191 -1.979 0 C-N-CA 118.954 -1.099 . . . . 0.0 111.532 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.96 -30.08 71.19 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -72.65 -49.8 29.36 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.811 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -42.48 98.56 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -57.75 -49.12 77.65 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 125.328 1.451 . . . . 0.0 109.781 174.889 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.3 t-80 -65.16 -50.86 64.33 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 123.223 0.327 . . . . 0.0 111.048 -173.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.6 pp -68.62 -30.99 69.83 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-O 120.991 0.424 . . . . 0.0 111.012 -176.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.7 pp -73.99 -35.54 64.45 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.79 -28.36 69.51 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.961 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 22.5 mm-40 -73.42 -42.58 61.88 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-O 120.994 0.426 . . . . 0.0 111.612 176.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.39 -37.45 74.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 118.626 -1.23 . . . . 0.0 110.632 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.6 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -68.77 -36.48 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.552 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 0.9 OUTLIER -51.4 -53.92 31.85 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.599 1.56 . . . . 0.0 110.801 173.508 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -67.08 -32.92 74.42 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.02 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.61 -42.98 97.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 123.045 0.215 . . . . 0.0 110.983 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.3 mt-30 -63.58 -52.25 61.78 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.567 0.699 . . . . 0.0 110.721 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 15.0 ptpt -71.05 -27.69 63.83 Favored 'General case' 0 N--CA 1.415 -2.179 0 C-N-CA 119.289 -0.964 . . . . 0.0 112.21 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.9 tp10 -59.98 -52.52 65.06 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -61.83 -42.13 98.65 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.791 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -59.26 -53.46 58.02 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.248 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -70.42 -37.04 74.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.773 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.051 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.78 -50.11 32.82 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' GLN . . . . . 0.469 HE22 ' HB3' ' A' ' 69' ' ' ALA . 81.1 mm-40 -61.18 -44.37 97.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.609 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.22 -46.79 88.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.036 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.83 -41.7 78.31 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 20.8 mt -60.34 -62.16 2.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.433 176.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 11.1 t -63.76 -26.76 68.79 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -74.86 -56.29 4.92 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.856 0.36 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.1 -41.49 50.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.439 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 29.8 t . . . . . 0 C--N 1.325 -0.494 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 92.2 mmm . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.555 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.285 43.7 mt-10 -47.16 -27.78 1.57 Allowed 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -173.422 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -73.82 -49.59 24.47 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 119.156 0.889 . . . . 0.0 110.897 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -73.4 -24.4 20.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-O 122.272 1.034 . . . . 0.0 110.079 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.555 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.7 mm -70.75 -35.51 60.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.539 172.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.45 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 38.7 ttt180 -59.08 -40.98 86.93 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.8 m -57.68 -53.34 59.27 Favored 'General case' 0 CA--C 1.553 1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.641 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -66.06 -38.64 88.85 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.474 HD22 HD21 ' A' ' 42' ' ' ASN . 4.1 pp -73.93 -31.45 63.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' MET . . . . . 0.436 ' N ' HD12 ' B' ' 149' ' ' LEU . 39.7 tpp . . . . . 0 CA--C 1.504 -0.802 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.441 0 N-CA-C 114.366 0.507 . . . . 0.0 114.366 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -67.27 -6.07 16.81 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -61.64 -30.65 70.85 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 120.861 0.362 . . . . 0.0 111.067 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -71.85 -21.98 61.59 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.376 0.608 . . . . 0.0 111.318 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -87.43 -33.03 19.21 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.888 -176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.532 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.6 p -87.54 110.5 20.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.993 0.901 . . . . 0.0 109.788 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -71.53 149.54 45.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.908 -176.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.84 -37.58 82.57 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -56.79 -42.64 79.84 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.287 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.32 -52.03 21.02 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.763 0.792 . . . . 0.0 109.167 -173.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.8 ptm180 -64.48 -38.5 91.24 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.239 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 t -73.9 -23.98 59.64 Favored 'General case' 0 N--CA 1.424 -1.765 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -70.94 -37.5 72.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -64.84 -40.22 94.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.394 174.359 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 83.9 t -58.84 -45.97 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.364 0.666 . . . . 0.0 109.652 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -55.47 -47.29 76.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.173 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.649 ' HD3' HD23 ' B' ' 115' ' ' LEU . 35.7 mttp -66.21 -36.87 84.17 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.312 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 19' ' ' VAL . 60.4 mt -56.41 -45.39 80.71 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 123.241 0.338 . . . . 0.0 110.188 174.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -48.87 83.98 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 O-C-N 123.772 0.67 . . . . 0.0 111.813 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -71.76 -23.58 61.62 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.502 -176.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.45 -41.34 21.98 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.406 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.551 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.52 -34.36 57.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.61 87.09 56.88 Favored Pre-proline 0 N--CA 1.41 -2.467 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.623 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -68.06 77.3 0.62 Allowed 'Trans proline' 0 C--O 1.262 1.685 0 C-N-CA 122.5 2.133 . . . . 0.0 108.61 168.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.4 t -54.88 143.95 49.29 Favored Pre-proline 0 N--CA 1.427 -1.621 0 CA-C-N 113.444 -1.707 . . . . 0.0 113.142 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.32 -36.31 28.18 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.264 1.976 . . . . 0.0 110.66 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -149.03 142.13 15.77 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -53.81 -21.12 19.27 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.256 2.637 . . . . 0.0 115.307 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.83 -11.06 59.66 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 121.035 -1.041 . . . . 0.0 112.468 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.44 -12.86 60.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.181 0.991 . . . . 0.0 108.758 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -84.2 7.23 19.72 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.463 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -132.98 20.41 4.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.766 0.793 . . . . 0.0 109.791 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 35.4 t70 -86.86 174.97 8.42 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.422 ' H ' ' HD2' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -65.82 -25.22 67.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.944 0.402 . . . . 0.0 110.375 175.366 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.502 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.9 ttm180 -65.56 -31.37 72.38 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 10.2 tpp -60.73 -39.27 88.01 Favored 'General case' 0 CA--C 1.496 -1.128 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.099 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -33.67 76.51 Favored 'General case' 0 C--O 1.199 -1.555 0 C-N-CA 117.381 -1.727 . . . . 0.0 110.048 -177.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -66.59 -46.29 76.43 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 124.039 0.837 . . . . 0.0 110.386 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 85.8 mt -65.72 -47.05 76.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.928 -177.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.6 p -73.27 -31.87 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.1 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.09 94.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -60.12 -47.41 86.01 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 124.208 1.003 . . . . 0.0 110.322 174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.15 -45.24 94.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.773 -0.194 . . . . 0.0 110.738 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HE2' HG22 ' A' ' 44' ' ' VAL . 62.6 mttm -62.85 -40.04 96.24 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.881 0.472 . . . . 0.0 111.474 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 48.4 pttt -73.55 -36.37 65.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.862 0.363 . . . . 0.0 110.979 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' A' ' 54' ' ' MET . 40.5 t -67.4 -45.92 84.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -54.98 -47.85 74.03 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.831 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.77 97.1 Favored Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.793 -0.64 . . . . 0.0 113.206 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.63 -54.32 48.41 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.762 0.315 . . . . 0.0 110.962 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.594 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 1.8 ptp -70.17 -30.88 68.13 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -60.99 -49.59 76.81 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.456 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 6.1 mm-40 -73.3 -24.31 60.39 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.448 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 37.9 m -76.16 -34.46 59.37 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.852 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.5 164.72 14.69 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.138 0.494 . . . . 0.0 111.967 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.04 15.37 13.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.001 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.5 m -158.4 150.48 21.65 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.532 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.38 -34.34 67.87 Favored 'General case' 0 C--O 1.187 -2.19 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.319 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -69.39 -32.24 71.12 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.874 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.502 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 11.9 tp10 -66.56 -51.68 53.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -39.25 92.23 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.784 -177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.683 ' CE1' HD13 ' B' ' 115' ' ' LEU . 11.9 t80 -61.46 -47.13 87.09 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.145 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.601 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 55.8 m80 -70.68 -43.54 68.84 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.594 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.6 pp -68.53 -31.09 70.07 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 120.379 -0.528 . . . . 0.0 112.186 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.7 OUTLIER -74.48 -39.27 62.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.538 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -54.22 -40.82 68.0 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.681 173.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 45.7 mm-40 -60.16 -48.56 81.23 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.511 0.672 . . . . 0.0 110.577 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 1.6 tptt -62.09 -48.31 80.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.322 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.591 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -34.34 67.35 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.186 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.466 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 5.4 t80 -55.5 -53.52 55.34 Favored 'General case' 0 C--O 1.257 1.477 0 C-N-CA 125.348 1.459 . . . . 0.0 110.943 174.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.7 ptpt -64.35 -34.36 77.97 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.717 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.482 HD13 ' HD2' ' A' ' 71' ' ' LYS . 1.5 mp -63.75 -43.95 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 123.326 0.391 . . . . 0.0 110.49 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.8 mt-30 -64.59 -52.12 59.17 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.9 -176.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.583 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.0 ptpt -71.16 -29.05 64.72 Favored 'General case' 0 N--CA 1.419 -1.997 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.1 -177.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.642 ' O ' ' HG3' ' A' ' 82' ' ' LYS . 48.9 tp10 -63.22 -51.77 64.9 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -64.0 -39.72 94.76 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.548 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -68.52 -44.37 74.76 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.7 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -69.17 -45.15 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 119.869 -0.732 . . . . 0.0 112.199 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.73 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.36 -53.12 48.17 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.481 -176.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . 0.366 4.0 pp0? -75.3 -27.61 59.4 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -176.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -73.68 -42.21 61.6 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.483 175.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.54 -45.78 90.79 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.683 HD13 ' CE1' ' A' ' 65' ' ' TYR . 9.0 mt -50.01 -61.77 1.96 Allowed 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.494 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -62.32 -42.29 99.25 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.623 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 41.9 m -63.94 -37.39 87.25 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.307 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -77.06 -53.1 8.21 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.323 -0.567 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -171.103 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.601 ' O ' HG12 ' B' ' 145' ' ' ILE . 7.7 tpt . . . . . 0 N--CA 1.444 -0.77 0 CA-C-O 121.708 0.765 . . . . 0.0 109.117 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.535 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 50.4 mt-10 -52.57 -27.22 15.86 Favored 'General case' 0 C--O 1.199 -1.586 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.9 p -58.06 -59.96 4.47 Favored 'General case' 0 C--O 1.265 1.87 0 CA-C-O 122.083 0.944 . . . . 0.0 110.926 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.465 HD11 ' SD ' ' B' ' 141' ' ' MET . 41.8 pt -64.61 -29.93 48.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.61 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.601 HG12 ' O ' ' B' ' 141' ' ' MET . 17.7 mm -67.25 -40.56 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.007 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 99.1 mtt180 -59.58 -42.01 91.56 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.2 m -58.07 -47.36 83.41 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.903 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.82 -38.4 73.28 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -71.09 -31.19 67.5 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.752 -0.592 . . . . 0.0 110.369 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.277 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.111 0 N-CA-C 114.93 0.732 . . . . 0.0 114.93 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.4 p-90 -72.32 -9.62 58.73 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.71 -15.72 54.09 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 10.9 pt-20 -89.09 -9.3 51.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.288 0.566 . . . . 0.0 110.086 177.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -96.24 4.23 52.52 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.272 0.558 . . . . 0.0 109.77 -178.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.549 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.1 t -118.46 113.0 40.52 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.412 0 N-CA-C 104.716 -2.328 . . . . 0.0 104.716 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.0 m -65.98 149.93 49.46 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.463 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 21.2 tm0? -57.35 -39.98 77.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.334 0.588 . . . . 0.0 109.503 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.469 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.1 m-20 -63.96 -35.01 79.29 Favored 'General case' 0 C--O 1.196 -1.719 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.04 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.39 -51.44 15.02 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.464 ' O ' HG23 ' A' ' 19' ' ' VAL . 11.9 ptm180 -59.41 -42.74 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.106 0.479 . . . . 0.0 111.278 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 21.2 t -73.0 -24.84 60.8 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.36 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.592 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 10.3 t60 -74.94 -34.8 62.13 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.339 0.59 . . . . 0.0 109.749 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.494 HD23 HD21 ' A' ' 68' ' ' LEU . 2.0 mp -63.82 -39.14 93.53 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 173.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.8 t -59.05 -49.68 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-O 121.667 0.746 . . . . 0.0 109.464 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.461 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 28.5 t-80 -51.29 -49.46 61.24 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.925 1.29 . . . . 0.0 111.098 177.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 55.2 mttm -64.77 -36.87 85.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.395 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 91.8 mt -56.1 -47.51 77.92 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.389 0.431 . . . . 0.0 110.222 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.88 -49.15 84.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 O-C-N 123.769 0.668 . . . . 0.0 112.007 176.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -70.0 -23.21 63.11 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.449 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.2 -44.23 18.13 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.472 176.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.609 HD11 HG23 ' B' ' 145' ' ' ILE . 4.9 tt -70.73 -32.99 51.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.477 0.656 . . . . 0.0 110.149 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 1.2 m-85 -127.62 93.57 39.98 Favored Pre-proline 0 N--CA 1.416 -2.155 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.1 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 28.3 Cg_endo -66.86 96.42 0.37 Allowed 'Trans proline' 0 N--CA 1.446 -1.32 0 C-N-CA 121.794 1.663 . . . . 0.0 108.141 170.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 11.0 t -74.35 139.17 75.01 Favored Pre-proline 0 N--CA 1.419 -1.978 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.992 -171.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 -28.62 5.83 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.241 2.627 . . . . 0.0 111.717 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -140.23 146.23 44.99 Favored Pre-proline 0 CA--C 1.483 -1.629 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 -177.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -67.26 -12.58 36.43 Favored 'Trans proline' 0 C--N 1.323 -0.774 0 C-N-CA 121.411 1.408 . . . . 0.0 110.787 174.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.15 57.65 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.745 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -77.84 -11.8 59.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.101 0.953 . . . . 0.0 108.654 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.542 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.8 mt -87.79 3.82 46.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.828 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -133.04 21.52 4.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.697 0.761 . . . . 0.0 109.532 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.562 ' O ' ' HB3' ' A' ' 40' ' ' MET . 17.4 t70 -89.08 172.24 9.25 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.716 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.538 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.23 -25.76 65.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.419 0.628 . . . . 0.0 110.928 -178.788 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 -76.74 -16.21 59.55 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.613 0.72 . . . . 0.0 109.56 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.562 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.5 tpp -65.5 -40.31 92.9 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.182 176.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.5 pt-20 -62.09 -27.88 69.22 Favored 'General case' 0 C--O 1.192 -1.921 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.055 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.48 -47.41 55.67 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.196 0.598 . . . . 0.0 110.565 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.25 -45.96 75.15 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.426 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -72.6 -30.74 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.141 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.43 94.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.6 t80 -56.92 -46.59 81.89 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.675 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.78 -47.8 81.91 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.441 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -62.59 -40.11 95.85 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.14 0.576 . . . . 0.0 112.362 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.8 pttp -72.51 -38.32 68.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.809 0.338 . . . . 0.0 110.681 -177.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.6 t -69.28 -47.08 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -58.71 -47.6 84.02 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.663 0.785 . . . . 0.0 109.34 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.51 -39.73 93.49 Favored Glycine 0 C--O 1.224 -0.507 0 O-C-N 123.644 0.59 . . . . 0.0 112.667 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -59.84 -54.75 42.56 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.946 0.403 . . . . 0.0 111.19 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.46 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -66.74 -32.54 73.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.382 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.29 -49.78 76.25 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 123.902 0.881 . . . . 0.0 109.706 173.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.43 -21.08 60.56 Favored 'General case' 0 C--N 1.31 -1.152 0 O-C-N 122.033 -0.417 . . . . 0.0 111.986 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -84.55 -39.46 18.76 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.63 169.76 15.91 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -174.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.35 6.49 16.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.685 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -164.34 151.57 11.71 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -63.46 -35.77 81.54 Favored 'General case' 0 C--O 1.178 -2.676 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.141 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.17 -36.15 82.66 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 123.923 0.764 . . . . 0.0 110.379 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -71.81 -46.66 57.43 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.826 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -40.42 95.81 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.523 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.433 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.3 OUTLIER -56.15 -49.91 72.65 Favored 'General case' 0 C--O 1.209 -1.045 0 C-N-CA 125.13 1.372 . . . . 0.0 109.369 174.499 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.439 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 35.9 t-80 -64.58 -54.16 36.39 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.419 -172.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.459 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.82 -29.97 69.26 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.447 -177.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.494 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -74.02 -38.26 64.11 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.725 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.7 -32.34 73.41 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 123.398 0.437 . . . . 0.0 109.838 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 12.1 mm-40 -70.85 -41.56 71.29 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 176.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -37.59 66.65 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 118.954 -1.098 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.7 tt -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.54 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.85 -54.12 38.92 Favored 'General case' 0 C--O 1.252 1.205 0 C-N-CA 125.004 1.321 . . . . 0.0 111.269 174.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -67.91 -34.81 77.35 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.911 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.97 -42.81 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 123.558 0.536 . . . . 0.0 110.476 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.4 mt-30 -61.82 -57.02 13.43 Favored 'General case' 0 CA--C 1.484 -1.567 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.081 -178.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.6 ptpt -66.23 -32.5 73.96 Favored 'General case' 0 N--CA 1.418 -2.057 0 C-N-CA 119.78 -0.768 . . . . 0.0 112.839 -176.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -59.45 -52.68 64.56 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -68.2 -41.7 80.96 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.964 -177.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.7 -43.34 99.05 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.6 pt-20 -75.5 -36.66 60.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.657 -177.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.449 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.519 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.442 -0.856 0 CA-C-O 120.269 0.081 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.42 -48.29 56.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -60.66 -43.76 97.26 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.291 0.369 . . . . 0.0 111.107 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.71 -38.58 80.35 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.176 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 110' ' ' THR . 81.7 mt -63.16 -38.89 92.97 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.294 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -56.7 -66.58 0.42 Allowed 'General case' 0 C--O 1.214 -0.808 0 O-C-N 123.362 0.414 . . . . 0.0 110.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.433 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 9.0 t -56.96 -46.94 81.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -173.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.1 t -72.21 -46.82 54.6 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.994 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -76.58 -36.34 57.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.542 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 72.6 p . . . . . 0 CA--C 1.504 -0.797 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -177.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.624 ' SD ' HD11 ' B' ' 144' ' ' ILE . 13.9 tpt . . . . . 0 C--O 1.24 0.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.599 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.4 mt-10 -49.66 -26.46 3.71 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.3 p -60.31 -59.47 5.36 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 121.362 0.601 . . . . 0.0 111.534 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.624 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.6 pp -70.78 -24.94 25.4 Favored 'Isoleucine or valine' 0 C--O 1.264 1.826 0 CA-C-O 122.28 1.038 . . . . 0.0 111.469 177.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.609 HG23 HD11 ' A' ' 26' ' ' ILE . 15.2 mm -65.1 -39.29 85.1 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.201 172.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -65.52 -40.7 93.27 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.885 177.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 5.2 p -60.75 -28.87 69.03 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.919 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -79.56 -52.23 8.27 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 119.13 -1.028 . . . . 0.0 112.198 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 2.4 pp -72.88 -23.12 60.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 17.0 tpt . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 109.928 -178.93 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 N-CA-C 115.578 0.991 . . . . 0.0 115.578 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.5 p-90 -67.46 -9.2 39.68 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -67.09 -17.73 65.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.188 0.518 . . . . 0.0 110.765 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.87 -10.0 59.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 121.243 0.544 . . . . 0.0 109.794 176.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -96.72 4.55 51.76 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.48 -178.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.467 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -138.09 110.66 6.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-O 122.068 0.937 . . . . 0.0 109.363 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -86.63 162.92 17.7 Favored 'General case' 0 N--CA 1.414 -2.245 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.788 -177.039 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -59.85 -36.85 77.71 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.754 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -57.25 -45.5 83.93 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' B' ' 119' ' ' SER . 3.3 tm? -69.61 -50.98 39.24 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.718 0.771 . . . . 0.0 108.945 -175.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.544 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.5 ptm180 -66.41 -41.35 89.4 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.064 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.404 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 14.5 t -70.79 -25.36 62.85 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 46.9 t60 -67.66 -40.55 84.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.517 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -65.32 -36.12 83.06 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.078 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -59.55 -44.73 93.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 123.521 0.728 . . . . 0.0 109.358 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.44 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.8 t-80 -58.77 -42.34 88.71 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.127 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.612 ' HD3' HD23 ' B' ' 115' ' ' LEU . 72.7 mttt -71.27 -36.32 71.68 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.1 mt -57.02 -44.09 82.49 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.9 t -58.01 -50.41 78.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 O-C-N 124.117 0.886 . . . . 0.0 111.827 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.65 -17.67 62.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.62 -46.33 13.42 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.452 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.654 HD11 HG23 ' B' ' 145' ' ' ILE . 4.4 tt -70.69 -36.79 66.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 122.05 0.929 . . . . 0.0 108.925 -177.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 5.5 m-85 -130.16 88.06 49.27 Favored Pre-proline 0 N--CA 1.397 -3.087 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.624 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -61.6 94.44 0.12 Allowed 'Trans proline' 0 N--CA 1.438 -1.74 0 C-N-CA 121.878 1.719 . . . . 0.0 108.489 173.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -68.72 136.75 90.26 Favored Pre-proline 0 N--CA 1.401 -2.923 0 CA-C-N 113.883 -1.508 . . . . 0.0 111.68 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.18 -32.52 4.06 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.511 2.141 . . . . 0.0 110.612 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -137.46 146.27 52.88 Favored Pre-proline 0 CA--C 1.482 -1.659 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.122 -174.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -68.5 -11.45 31.98 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.626 1.551 . . . . 0.0 111.446 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.88 -9.23 54.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.57 -13.41 59.92 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.3 mt -84.53 7.24 20.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 113.921 -1.49 . . . . 0.0 110.612 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.87 14.04 4.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.756 0.789 . . . . 0.0 109.613 176.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.6 t70 -81.16 171.04 15.38 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.526 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.435 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.18 -28.57 69.84 Favored 'General case' 0 C--N 1.31 -1.129 0 O-C-N 122.14 -0.35 . . . . 0.0 111.289 -179.157 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.481 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 19.7 ttm180 -70.3 -20.16 63.04 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.574 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.7 tpp -63.84 -42.87 97.5 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.444 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.48 -33.87 73.22 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.86 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -68.69 -48.21 64.48 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 84.7 mt -67.48 -42.08 83.53 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.032 -178.196 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.574 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.0 p -73.09 -33.55 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -62.07 -48.82 78.49 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 175.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.59 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 1.7 t80 -56.28 -42.89 78.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.099 0.96 . . . . 0.0 110.512 174.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.453 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -69.14 -38.46 78.83 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.986 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.3 mttm -64.36 -39.57 94.14 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 120.67 0.271 . . . . 0.0 111.364 177.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 4.3 ptmt -68.0 -44.14 77.25 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.477 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.2 t -62.32 -50.44 79.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -56.31 -50.06 72.53 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.371 1.068 . . . . 0.0 109.26 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.78 -32.78 80.35 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.137 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -70.07 -49.34 52.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.932 0.396 . . . . 0.0 110.732 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.427 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -65.8 -30.33 70.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 177.651 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.468 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 78.1 t80 -61.75 -42.35 98.85 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 3.4 mm-40 -82.03 -13.27 57.61 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 t -87.63 -27.14 22.67 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-O 121.105 0.479 . . . . 0.0 110.56 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -95.55 165.83 12.15 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -116.54 8.52 13.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.709 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.0 p -158.42 156.66 30.81 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -32.94 67.35 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.853 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.78 -37.63 88.27 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 178.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -64.96 -47.47 77.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.903 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -40.99 98.32 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.048 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.697 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 7.0 t80 -64.01 -42.98 96.98 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.161 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.505 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.4 m80 -62.77 -57.21 11.73 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.05 176.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.1 pp -64.23 -30.22 71.29 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -173.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.511 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -72.36 -46.51 55.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 175.606 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.512 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -53.86 -34.27 58.88 Favored 'General case' 0 C--O 1.207 -1.16 0 O-C-N 123.825 0.703 . . . . 0.0 110.809 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.707 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 14.1 mt-10 -74.09 -45.35 49.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -67.72 -37.69 82.58 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.944 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 2.4 tt -69.31 -35.67 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.707 ' CD2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -69.45 -38.54 77.82 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.286 -178.716 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -68.19 -33.29 74.16 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.386 0.428 . . . . 0.0 110.068 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.66 -41.45 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.066 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 49.7 mt-30 -65.37 -45.43 84.12 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 120.957 0.408 . . . . 0.0 110.617 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.5 ptpt -71.41 -26.98 62.99 Favored 'General case' 0 N--CA 1.424 -1.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.72 -47.02 73.66 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -66.38 -34.42 77.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.084 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -65.66 -53.32 42.96 Favored 'General case' 0 N--CA 1.407 -2.579 0 C-N-CA 124.007 0.923 . . . . 0.0 110.314 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -62.29 -38.18 88.38 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.498 ' HE2' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.026 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.426 -1.672 0 CA-C-O 121.043 0.449 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.93 -51.98 16.4 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.535 -173.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -67.52 -36.73 81.6 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.517 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.69 -46.36 82.71 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.006 0.432 . . . . 0.0 110.112 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.83 -44.78 96.48 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.261 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.697 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 21.9 mt -55.09 -67.29 0.28 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.856 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 13.7 t -58.0 -28.91 64.85 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.8 p -73.97 -52.6 12.31 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.809 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.529 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 53.6 m-20 -76.21 -43.74 40.88 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 119.154 -1.018 . . . . 0.0 112.319 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.469 ' HB3' HD22 ' A' ' 14' ' ' LEU . 20.1 m . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 121.547 0.689 . . . . 0.0 111.705 -173.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.498 ' SD ' ' HE2' ' A' ' 82' ' ' LYS . 11.9 tpt . . . . . 0 C--O 1.239 0.501 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.603 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -50.89 -27.13 6.83 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.0 m -58.78 -53.53 57.38 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-O 121.053 0.454 . . . . 0.0 110.681 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . 0.25 2.7 pp -73.92 -24.17 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 121.164 0.506 . . . . 0.0 111.147 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.654 HG23 HD11 ' A' ' 26' ' ' ILE . 13.8 mm -65.17 -42.52 94.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.081 172.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.474 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 49.0 ttp180 -62.08 -37.67 85.91 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.674 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.2 m -56.55 -53.89 52.28 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 123.662 0.601 . . . . 0.0 110.224 172.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.2 -41.54 90.05 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG 0.268 3.4 pp -68.29 -31.23 70.53 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.57 -0.707 . . . . 0.0 111.764 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 C--N 1.318 -0.776 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.454 177.092 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.912 0 N-CA-C 116.424 1.33 . . . . 0.0 116.424 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -79.9 -3.0 46.18 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 121.543 -0.975 . . . . 0.0 110.027 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -60.84 -32.34 71.74 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 125.936 1.695 . . . . 0.0 108.809 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -81.71 -4.26 55.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.147 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -109.23 -15.67 14.24 Favored 'General case' 0 CA--C 1.499 -1.002 0 CA-C-O 121.3 0.571 . . . . 0.0 111.627 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 7.5 p -101.98 109.8 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.179 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -81.22 150.5 28.58 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.256 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -56.21 -39.96 73.29 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 123.542 0.526 . . . . 0.0 110.146 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -64.07 -33.58 76.08 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.859 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.72 -48.08 34.64 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 8.3 ptm180 -69.8 -41.49 74.97 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.276 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.7 t -70.18 -23.09 62.91 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.484 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 18.8 t60 -71.07 -42.37 69.5 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 68' ' ' LEU . 1.9 mp -62.06 -38.25 88.07 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.463 176.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 93.8 t -60.31 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.19 0.596 . . . . 0.0 109.505 172.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -52.96 -46.61 68.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.699 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.484 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 61.5 mttm -65.66 -39.47 91.4 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.7 mt -55.31 -45.5 76.32 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.358 0.411 . . . . 0.0 110.142 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.9 t -60.49 -55.01 27.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 O-C-N 123.852 0.72 . . . . 0.0 111.187 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.04 -26.74 68.42 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -176.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.52 -45.84 15.35 Favored 'General case' 0 C--O 1.206 -1.228 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.576 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.541 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.2 tt -70.43 -28.35 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 121.952 0.882 . . . . 0.0 109.639 -177.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.1 86.5 51.22 Favored Pre-proline 0 N--CA 1.394 -3.25 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.445 -177.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.76 98.49 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.399 0 C-N-CA 122.244 1.963 . . . . 0.0 107.413 168.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 t -73.61 142.86 81.32 Favored Pre-proline 0 N--CA 1.408 -2.546 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.653 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.53 -24.74 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.385 2.056 . . . . 0.0 111.435 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -155.7 142.61 13.55 Favored Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -174.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.31 -24.68 61.25 Favored 'Trans proline' 0 C--N 1.321 -0.873 0 C-N-CA 122.73 2.287 . . . . 0.0 114.659 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.33 -8.11 58.83 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.248 -0.908 . . . . 0.0 111.936 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.2 -11.39 59.82 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.733 0.777 . . . . 0.0 109.185 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.7 mt -87.73 3.49 47.83 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.262 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.0 19.22 4.1 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 122.534 1.159 . . . . 0.0 109.169 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.0 t70 -83.34 177.77 8.35 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.092 -177.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.29 -33.26 71.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.123 0.487 . . . . 0.0 110.158 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -69.21 -20.33 63.98 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 122.112 0.958 . . . . 0.0 109.935 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.607 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -62.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.696 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 38' ' ' ARG . 0.2 OUTLIER -62.39 -32.77 73.64 Favored 'General case' 0 C--O 1.174 -2.895 0 C-N-CA 118.144 -1.422 . . . . 0.0 110.785 -178.396 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.21 -47.98 66.43 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.591 0.557 . . . . 0.0 110.872 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.6 -44.64 77.62 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.863 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.607 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.7 p -73.46 -32.72 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.027 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.45 94.58 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.629 0.728 . . . . 0.0 109.094 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.497 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -58.56 -47.09 85.38 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.496 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.01 98.17 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.801 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 94.1 mttt -63.24 -44.0 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.106 0.563 . . . . 0.0 111.315 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.5 pttp -68.46 -39.42 81.43 Favored 'General case' 0 C--O 1.25 1.095 0 CA-C-O 121.307 0.575 . . . . 0.0 110.605 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.42 -50.83 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.687 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -56.71 -48.51 77.55 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.142 0.977 . . . . 0.0 109.668 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.97 -40.24 93.01 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.38 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -61.52 -55.25 33.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-O 120.336 0.112 . . . . 0.0 110.879 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -64.75 -28.61 69.7 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.735 0.642 . . . . 0.0 112.735 179.743 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -64.53 -51.68 61.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -70.64 -24.42 62.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.62 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 64.9 m -82.29 -33.61 29.0 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.5 164.75 18.61 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.326 0.584 . . . . 0.0 112.422 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -113.15 13.6 19.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.402 0.62 . . . . 0.0 111.351 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.6 p -163.78 153.9 15.16 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 171.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -70.36 -33.67 71.72 Favored 'General case' 0 C--O 1.188 -2.177 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.312 -178.924 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.97 -35.82 82.41 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -67.07 -46.91 72.87 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.286 175.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.63 -44.82 95.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.773 0.671 . . . . 0.0 109.609 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -49.33 75.61 Favored 'General case' 0 C--O 1.208 -1.125 0 C-N-CA 125.077 1.351 . . . . 0.0 109.492 175.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -63.5 -49.61 72.87 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.62 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.5 pp -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.628 -176.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.06 -36.89 58.82 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 177.444 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.613 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -36.56 84.14 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.02 -47.29 83.71 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.633 0.73 . . . . 0.0 110.954 174.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -44.38 93.98 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.5 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.613 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.9 tt -69.58 -35.77 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.374 -177.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.549 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.46 -54.25 43.44 Favored 'General case' 0 C--O 1.26 1.625 0 C-N-CA 124.525 1.13 . . . . 0.0 110.936 175.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.15 -32.4 73.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.374 -176.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.24 -45.71 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.821 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.636 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 36.4 mt-30 -59.28 -53.83 53.75 Favored 'General case' 0 CA--C 1.481 -1.705 0 O-C-N 123.798 0.686 . . . . 0.0 111.364 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.648 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -67.7 -35.22 78.41 Favored 'General case' 0 N--CA 1.415 -2.21 0 C-N-CA 119.192 -1.003 . . . . 0.0 112.524 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 12.0 tp10 -59.98 -48.86 79.96 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.456 HD21 ' O ' ' A' ' 25' ' ' ALA . 4.6 pp -67.11 -43.77 81.64 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.6 -49.85 69.49 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 123.28 0.362 . . . . 0.0 111.356 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -68.36 -31.74 71.33 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? . . . . . 0 N--CA 1.453 -0.294 0 C-N-CA 120.107 -0.637 . . . . 0.0 111.45 178.715 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 5.3 t . . . . . 0 N--CA 1.434 -1.26 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.54 -42.82 67.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.973 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.57 -35.31 79.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -66.52 -44.47 82.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.056 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 110' ' ' THR . 71.8 mt -60.5 -42.73 96.94 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.041 0.448 . . . . 0.0 109.795 177.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.435 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 3.1 mm? -53.63 -59.02 5.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.686 175.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 19.4 m -60.93 -44.14 97.64 Favored 'General case' 0 C--O 1.247 0.929 0 O-C-N 123.858 0.724 . . . . 0.0 111.347 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 44.7 m -62.9 -46.66 86.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.537 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.432 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 17.2 m-20 -76.22 -41.36 49.55 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 118.556 -1.258 . . . . 0.0 111.835 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 53.7 p . . . . . 0 C--N 1.326 -0.431 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -173.423 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 144' ' ' ILE . 10.8 tpt . . . . . 0 C--O 1.246 0.906 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.633 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.2 mt-10 -47.53 -26.17 1.34 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.2 m -55.94 -59.26 5.15 Favored 'General case' 0 C--O 1.259 1.599 0 CA-C-O 121.701 0.762 . . . . 0.0 111.138 174.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' B' ' 141' ' ' MET 0.291 2.6 pp -72.52 -23.59 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 O-C-N 121.356 -0.84 . . . . 0.0 111.674 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.633 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 29.2 mm -67.39 -38.55 80.99 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.801 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.675 172.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.433 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 15.2 tpp180 -59.14 -43.96 92.04 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.2 m -58.37 -48.16 81.51 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.598 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -72.07 -37.35 69.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.433 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.9 pp -68.34 -24.58 64.83 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.332 -0.855 . . . . 0.0 110.27 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.3 tpt . . . . . 0 N--CA 1.437 -1.081 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 173.11 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.376 0 N-CA-C 114.404 0.521 . . . . 0.0 114.404 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.521 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 65.4 p-90 -63.91 -19.89 65.44 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -61.94 -20.72 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.277 0.56 . . . . 0.0 111.393 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -82.5 -10.78 58.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -108.58 8.31 27.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.867 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.434 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -129.66 118.54 45.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 CA-C-O 121.317 0.579 . . . . 0.0 110.043 -177.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -85.8 153.1 22.51 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.287 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.93 -38.29 70.09 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-O 121.016 0.436 . . . . 0.0 110.765 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.73 -27.72 65.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.434 HD12 HG23 ' A' ' 10' ' ' VAL . 2.6 tm? -73.38 -51.15 18.39 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.1 ptm180 -64.78 -38.28 90.45 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.837 -179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.412 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.8 t -70.01 -26.41 64.05 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -73.53 -36.17 65.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.538 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -63.43 -39.13 93.65 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 70.2 t -59.19 -49.93 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.405 0.682 . . . . 0.0 109.31 172.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -52.31 -46.33 65.95 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 124.569 1.148 . . . . 0.0 110.814 176.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.414 ' CE ' ' HB2' ' B' ' 118' ' ' ASP . 55.0 mttm -64.15 -42.36 96.81 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.277 177.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 19' ' ' VAL . 89.4 mt -54.63 -46.06 73.83 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -57.38 -49.97 78.43 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.758 175.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -68.03 -24.15 65.07 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.554 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.37 -46.34 16.21 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.003 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.56 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.9 tt -70.89 -29.33 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.958 0.885 . . . . 0.0 110.003 -178.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -127.14 90.74 48.41 Favored Pre-proline 0 N--CA 1.401 -2.901 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.025 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -55.64 127.31 25.63 Favored 'Trans proline' 0 N--CA 1.447 -1.244 0 C-N-CA 122.398 2.065 . . . . 0.0 108.22 170.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 p -70.46 120.59 79.61 Favored Pre-proline 0 C--N 1.283 -2.308 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -87.17 -26.5 0.82 Allowed 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.067 1.178 . . . . 0.0 109.046 167.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -154.13 140.61 12.9 Favored Pre-proline 0 CA--C 1.495 -1.149 0 C-N-CA 125.471 1.508 . . . . 0.0 107.225 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -67.42 -19.48 49.24 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.276 1.318 . . . . 0.0 110.586 171.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.61 -6.81 59.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -13.99 59.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 122.333 1.063 . . . . 0.0 108.43 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.0 4.49 16.82 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.102 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.41 22.92 3.73 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.16 0.505 . . . . 0.0 110.987 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.482 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 10.2 t70 -87.56 -176.99 5.78 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.482 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.3 -17.44 62.46 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 119.823 1.192 . . . . 0.0 110.418 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 21.9 ttm180 -70.97 -20.31 62.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.404 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.68 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.8 tpp -66.94 -42.89 84.52 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.07 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.8 pt-20 -59.86 -29.53 68.36 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.062 -0.655 . . . . 0.0 109.869 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.42 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.3 t30 -73.61 -51.53 16.52 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 124.571 1.148 . . . . 0.0 110.346 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.22 -44.17 80.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.749 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.68 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -72.62 -33.33 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.893 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.071 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.57 -45.26 89.38 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.583 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.0 t80 -60.41 -50.49 73.37 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.696 174.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.88 -39.66 90.07 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 120.714 0.292 . . . . 0.0 110.951 -176.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.2 mttt -65.22 -45.24 85.5 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 123.373 0.669 . . . . 0.0 111.552 177.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.9 pttp -65.72 -39.25 90.98 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.152 0.501 . . . . 0.0 109.726 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 54' ' ' MET . 53.5 t -67.09 -52.39 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.807 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -55.59 -50.11 70.97 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 124.122 0.889 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.06 -40.7 97.42 Favored Glycine 0 CA--C 1.507 -0.461 0 O-C-N 123.607 0.567 . . . . 0.0 112.642 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.39 -54.26 48.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.031 0.443 . . . . 0.0 110.187 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.577 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.6 ptp -70.26 -30.51 67.56 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.28 -40.97 97.05 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.74 -24.97 44.53 Favored 'General case' 0 C--N 1.313 -1.003 0 O-C-N 121.149 -0.969 . . . . 0.0 112.067 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.472 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 50.0 m -86.67 -18.8 30.37 Favored 'General case' 0 C--N 1.277 -2.561 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -175.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.25 160.14 14.82 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -98.59 -2.66 38.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.689 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.521 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 81.2 p -158.64 161.67 37.2 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.41 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -70.48 -29.74 66.36 Favored 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.915 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.77 -41.57 83.08 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 7.6 tp10 -62.97 -49.53 74.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 176.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -43.64 98.25 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.782 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.506 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -54.21 -48.88 70.55 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 172.625 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -65.0 -55.8 16.87 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.787 -172.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 54' ' ' MET . 2.1 pp -65.62 -30.16 70.84 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.538 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.92 -39.26 56.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 177.871 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.66 -32.94 73.14 Favored 'General case' 0 C--N 1.351 0.639 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.9 mm-40 -65.56 -47.08 77.05 Favored 'General case' 0 C--O 1.249 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 111.705 174.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -36.3 66.78 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.039 -1.064 . . . . 0.0 112.048 -177.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.8 tt -65.35 -37.8 80.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.785 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.5 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 12.5 t80 -54.25 -54.02 45.77 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 124.599 1.16 . . . . 0.0 111.907 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -65.41 -32.94 74.83 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.848 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.6 -41.02 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 51.5 mt-30 -64.27 -48.26 76.4 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.537 0.684 . . . . 0.0 110.622 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.84 -26.55 59.78 Favored 'General case' 0 N--CA 1.398 -3.057 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.6 tt0 -61.51 -48.63 80.17 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.737 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -66.51 -38.2 86.69 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.926 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -64.11 -47.85 78.4 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -63.48 -41.06 98.58 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 118.268 0.485 . . . . 0.0 111.543 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.443 -0.777 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.434 -178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.648 ' HA ' ' OD2' ' B' ' 113' ' ' ASP . 7.6 t . . . . . 0 C--O 1.218 -0.599 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.79 -35.53 81.38 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.256 175.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -64.55 -40.16 95.07 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 113' ' ' ASP . . . . . 0.648 ' OD2' ' HA ' ' B' ' 110' ' ' THR . 38.2 m-20 -54.17 -48.51 70.85 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.39 0.431 . . . . 0.0 110.417 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.78 -46.12 88.26 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.802 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -57.71 -63.45 1.24 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.835 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.506 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 14.9 t -60.17 -39.29 85.9 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.7 t -71.74 -47.54 53.1 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.074 -174.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 15.9 m-20 -71.73 -54.2 11.05 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.72 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 C--N 1.317 -0.834 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -171.365 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.737 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 21.3 ttt . . . . . 0 N--CA 1.441 -0.886 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.55 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 42.9 mt-10 -57.71 -26.74 62.19 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 26.0 m -66.88 -49.11 66.68 Favored 'General case' 0 C--O 1.26 1.614 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.975 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.9 pp -71.12 -28.06 31.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.834 0.826 . . . . 0.0 110.183 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.56 ' CG2' HD11 ' A' ' 26' ' ' ILE . 12.1 mm -67.79 -44.48 85.58 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.252 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.138 174.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -60.62 -39.1 86.97 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 22.9 t -61.24 -50.63 72.28 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.66 -53.16 61.24 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.454 1.101 . . . . 0.0 112.588 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.502 HD12 ' N ' ' B' ' 150' ' ' MET . 3.7 pp -72.71 -31.18 64.8 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -173.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' MET . . . . . 0.502 ' N ' HD12 ' B' ' 149' ' ' LEU . 49.5 tpp . . . . . 0 C--N 1.315 -0.899 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.454 -174.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.37 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.489 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 62.4 p-90 -63.98 -17.84 63.68 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -69.35 -13.47 62.39 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.876 -177.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -89.61 -2.98 58.48 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.485 0.659 . . . . 0.0 109.788 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -95.62 -13.17 24.56 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.528 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.71 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -104.77 110.77 31.79 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.722 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.8 m -73.3 149.61 42.55 Favored 'General case' 0 C--N 1.279 -2.459 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -56.6 -38.48 72.08 Favored 'General case' 0 C--O 1.209 -1.049 0 O-C-N 123.556 0.535 . . . . 0.0 109.654 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.89 -29.02 68.02 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.64 -52.97 9.33 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.2 ptm180 -58.66 -41.79 86.92 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.178 176.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.5 t -69.21 -25.4 64.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.442 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 15.2 t60 -67.98 -38.95 83.31 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.432 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -67.8 -37.72 82.38 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.811 177.281 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.2 t -57.04 -47.87 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-O 121.548 0.69 . . . . 0.0 109.384 174.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.2 t-80 -53.93 -50.66 65.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.503 176.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' B' ' 115' ' ' LEU . 54.8 mttm -64.6 -37.11 86.45 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.6 mt -55.58 -43.92 76.4 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.342 0.401 . . . . 0.0 109.941 176.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' HB3' ' A' ' 43' ' ' LEU . 2.3 t -60.08 -53.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 123.684 0.615 . . . . 0.0 111.905 175.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -65.48 -27.53 68.56 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.817 0.341 . . . . 0.0 111.624 -176.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.33 -43.2 19.41 Favored 'General case' 0 N--CA 1.424 -1.765 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.947 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.588 HD11 HG23 ' B' ' 145' ' ' ILE . 1.8 tt -70.22 -39.93 77.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.405 0 CA-C-O 121.606 0.717 . . . . 0.0 109.66 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.44 ' CD2' ' HD3' ' A' ' 39' ' ' ARG . 4.4 m-85 -125.66 102.29 29.28 Favored Pre-proline 0 N--CA 1.401 -2.887 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.759 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 51.1 Cg_exo -48.86 140.89 22.59 Favored 'Trans proline' 0 N--CA 1.438 -1.766 0 C-N-CA 123.294 2.663 . . . . 0.0 111.347 175.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.45 109.92 63.49 Favored Pre-proline 0 N--CA 1.382 -3.847 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.481 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.07 -26.92 4.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 121.92 1.747 . . . . 0.0 110.622 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -156.42 143.23 13.46 Favored Pre-proline 0 N--CA 1.433 -1.322 0 N-CA-C 106.22 -1.77 . . . . 0.0 106.22 -176.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.91 -21.82 42.87 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.612 2.208 . . . . 0.0 113.761 176.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -18.02 63.64 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.561 -0.712 . . . . 0.0 112.306 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.3 -14.76 63.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.652 0.739 . . . . 0.0 110.173 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.485 ' O ' ' HG2' ' A' ' 40' ' ' MET . 13.2 mt -91.32 1.78 56.86 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.569 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -133.16 14.91 4.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 122.076 0.941 . . . . 0.0 109.677 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 21.3 t70 -79.38 174.29 11.72 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.302 179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -25.89 63.01 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.543 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.44 ' HD3' ' CD2' ' A' ' 27' ' ' PHE . 23.9 ttm180 -61.03 -27.87 68.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.624 175.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.527 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 11.1 tpp -62.75 -42.49 99.7 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.773 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.54 -33.31 72.49 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 119.589 -0.844 . . . . 0.0 109.689 -176.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -71.97 -45.54 60.63 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.454 1.101 . . . . 0.0 110.479 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.485 ' HB3' HG22 ' A' ' 23' ' ' VAL . 95.5 mt -67.31 -45.32 76.81 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.327 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.513 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -72.83 -32.19 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 C-N-CA 120.534 -0.467 . . . . 0.0 110.239 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.89 -43.67 98.37 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.2 t80 -61.47 -51.45 68.61 Favored 'General case' 0 C--O 1.208 -1.085 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.975 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.24 87.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.629 0.252 . . . . 0.0 111.334 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -64.8 -42.64 94.88 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.4 pttp -70.5 -35.59 73.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.272 0.558 . . . . 0.0 110.208 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 46' ' ' TYR . 54.6 t -65.32 -49.68 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.162 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -55.43 -51.9 65.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.271 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.34 -38.85 91.66 Favored Glycine 0 C--N 1.333 0.393 0 O-C-N 123.642 0.589 . . . . 0.0 112.975 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.14 -54.12 45.68 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.254 0.55 . . . . 0.0 111.054 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 1.2 ptp -69.49 -27.82 65.53 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -62.47 -54.14 44.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.92 -17.81 60.5 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.184 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.0 t -79.72 -19.64 48.36 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 120.741 0.305 . . . . 0.0 110.96 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.48 165.25 12.09 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -175.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.43 6.12 37.46 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.284 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.489 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 7.2 t -173.59 162.66 4.21 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.71 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.95 -30.37 71.35 Favored 'General case' 0 C--O 1.168 -3.197 0 O-C-N 123.804 0.69 . . . . 0.0 110.77 178.18 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.12 -47.39 78.21 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.891 0.853 . . . . 0.0 109.543 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -71.6 -43.8 65.58 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.494 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.402 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.62 -40.12 94.93 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.646 ' CE1' HD13 ' B' ' 115' ' ' LEU . 5.1 t80 -60.6 -47.05 87.93 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.207 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.65 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 85.7 t60 -63.35 -53.76 47.5 Favored 'General case' 0 C--O 1.205 -1.253 0 O-C-N 123.716 0.635 . . . . 0.0 111.524 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.5 pp -67.87 -30.47 69.84 Favored 'General case' 0 C--O 1.256 1.43 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.167 -174.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.432 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.23 -44.05 63.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 174.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -52.95 -33.0 48.91 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.394 0.678 . . . . 0.0 111.717 173.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 31.3 mt-10 -73.38 -44.63 58.17 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.549 0.214 . . . . 0.0 110.845 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.12 -37.74 78.49 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 118.687 -1.205 . . . . 0.0 110.509 -179.432 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.633 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -36.77 77.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.8 -54.29 36.19 Favored 'General case' 0 C--O 1.258 1.527 0 C-N-CA 124.505 1.122 . . . . 0.0 110.379 174.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.36 -31.82 70.49 Favored 'General case' 0 C--O 1.204 -1.334 0 O-C-N 123.8 0.688 . . . . 0.0 110.771 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.539 ' HA ' ' HE1' ' B' ' 141' ' ' MET . 1.3 mp -63.15 -46.93 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 O-C-N 123.389 0.431 . . . . 0.0 109.955 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 52.5 mt-30 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.699 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.578 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -74.07 -28.22 61.28 Favored 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.421 -176.925 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -62.49 -52.79 62.1 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.656 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -62.03 -44.54 96.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.927 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.3 OUTLIER -62.63 -53.63 51.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.698 -178.099 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.3 pt-20 -76.35 -34.77 58.95 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.88 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.029 -178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.435 -1.186 0 CA-C-O 121.244 0.545 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.54 -40.45 85.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.866 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' GLN . . . . . 0.482 ' HA ' HD12 ' B' ' 115' ' ' LEU . 74.9 mt-30 -64.52 -39.32 93.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.575 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.92 -50.96 68.79 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.647 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -42.23 90.94 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 123.166 0.291 . . . . 0.0 111.386 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.646 HD13 ' CE1' ' A' ' 65' ' ' TYR . 16.7 mt -51.44 -63.04 1.26 Allowed 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.643 0.59 . . . . 0.0 110.58 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 12.9 m -65.96 -28.48 68.93 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.495 -1.229 . . . . 0.0 112.298 -172.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.0 m -68.3 -40.66 81.66 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 120.631 -0.428 . . . . 0.0 109.957 176.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -76.15 -47.85 22.76 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.659 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 60.7 p . . . . . 0 C--N 1.321 -0.66 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.235 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.656 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.8 ttt . . . . . 0 N--CA 1.436 -1.155 0 CA-C-O 121.436 0.636 . . . . 0.0 111.436 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 13.4 tm-20 -56.55 -27.01 56.61 Favored 'General case' 0 C--O 1.2 -1.546 0 C-N-CA 124.096 0.958 . . . . 0.0 112.422 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 21.7 t -62.27 -49.95 73.65 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-N 117.97 0.35 . . . . 0.0 110.755 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.44 HD11 ' CG ' ' B' ' 141' ' ' MET 0.261 2.7 pp -70.29 -24.88 26.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.201 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.905 176.364 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.588 HG23 HD11 ' A' ' 26' ' ' ILE . 16.9 mm -63.13 -43.16 98.74 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.398 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 78.0 mtp180 -56.84 -45.1 82.59 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.304 0.641 . . . . 0.0 110.625 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 6.1 p -60.11 -36.64 77.91 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 119.542 -0.863 . . . . 0.0 113.255 176.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -76.11 -44.95 36.16 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.231 -0.988 . . . . 0.0 112.295 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.445 HD12 ' N ' ' B' ' 150' ' ' MET 0.262 3.1 pp -70.24 -33.55 71.78 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.211 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 150' ' ' MET . . . . . 0.445 ' N ' HD12 ' B' ' 149' ' ' LEU . 50.5 ttm . . . . . 0 C--N 1.321 -0.657 0 CA-C-O 121.242 0.544 . . . . 0.0 111.039 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.506 0 N-CA-C 116.156 1.223 . . . . 0.0 116.156 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -76.01 -2.14 29.15 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 117.48 0.64 . . . . 0.0 112.087 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -62.53 -21.33 65.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.449 0.642 . . . . 0.0 110.793 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -86.2 -10.55 54.49 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.809 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -102.85 5.21 38.47 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.867 0.841 . . . . 0.0 110.09 -177.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.3 p -129.31 110.79 21.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.5 m -83.22 151.04 25.84 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.456 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.6 tm0? -51.77 -38.8 56.98 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.934 0.894 . . . . 0.0 111.33 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -69.73 -30.05 67.56 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.409 HD12 HG23 ' A' ' 10' ' ' VAL . 2.9 tm? -74.76 -47.69 29.71 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 -177.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.538 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -64.93 -41.25 95.7 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.621 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 t -69.6 -25.35 63.92 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.596 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 15.6 t60 -75.31 -36.86 61.04 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.888 177.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 HD21 ' A' ' 68' ' ' LEU . 1.4 mp -63.29 -37.63 87.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 173.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 15' ' ' ARG . 99.5 t -60.21 -45.78 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 19.4 t-80 -55.77 -47.04 77.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.881 177.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -66.49 -39.21 88.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.78 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 26' ' ' ILE . 28.8 mt -53.47 -48.35 68.94 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 123.547 0.529 . . . . 0.0 109.799 173.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.431 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.8 t -54.67 -48.64 71.72 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 O-C-N 124.237 0.96 . . . . 0.0 111.612 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -69.37 -24.19 63.85 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -44.55 16.24 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.503 175.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.679 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.09 -29.61 37.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.958 0.885 . . . . 0.0 109.517 -177.743 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -123.46 84.62 52.65 Favored Pre-proline 0 N--CA 1.403 -2.822 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.899 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.87 115.95 2.68 Favored 'Trans proline' 0 N--CA 1.443 -1.468 0 C-N-CA 122.396 2.064 . . . . 0.0 109.072 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.47 118.05 67.92 Favored Pre-proline 0 N--CA 1.394 -3.225 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -168.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -78.92 -25.31 6.28 Favored 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 121.698 1.599 . . . . 0.0 109.537 172.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -167.42 145.43 4.0 Favored Pre-proline 0 CA--C 1.506 -0.731 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.23 -22.95 74.97 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.851 2.367 . . . . 0.0 114.167 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.19 -5.91 53.24 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.029 -1.044 . . . . 0.0 111.778 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.42 -8.36 59.05 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 40' ' ' MET . 28.6 mt -89.55 7.09 38.07 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.55 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.68 22.12 4.27 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.197 0.998 . . . . 0.0 108.944 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.597 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.3 t70 -95.61 172.68 7.91 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.058 -176.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -68.12 -22.84 64.86 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 122.794 0.437 . . . . 0.0 111.476 -178.438 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -79.05 -17.16 55.73 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.713 0.768 . . . . 0.0 109.416 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.597 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.3 tpp -62.98 -43.14 99.6 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.124 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -56.04 -38.84 71.12 Favored 'General case' 0 C--O 1.193 -1.873 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.082 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.407 HD21 HD22 ' B' ' 149' ' ' LEU . 2.8 t30 -68.09 -45.0 74.99 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.782 0.833 . . . . 0.0 111.546 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 37.4 mt -67.89 -43.44 79.31 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.184 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 p -73.25 -33.22 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.263 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.07 -44.05 97.51 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.517 0.675 . . . . 0.0 109.392 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.679 ' CE1' HG13 ' A' ' 26' ' ' ILE . 3.9 t80 -61.0 -47.19 87.59 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.263 174.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.13 97.32 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.501 -177.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -63.03 -46.3 88.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.898 176.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 19.7 pttp -64.06 -39.13 93.4 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 121.021 0.439 . . . . 0.0 110.528 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.58 -50.39 66.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.134 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -57.01 -47.79 80.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.719 0.807 . . . . 0.0 109.896 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -42.83 93.66 Favored Glycine 0 N--CA 1.446 -0.682 0 O-C-N 123.666 0.603 . . . . 0.0 112.632 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.35 -54.11 50.53 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.368 0.604 . . . . 0.0 110.564 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.521 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 ptp -67.16 -33.14 74.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.61 -50.96 71.86 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.01 -18.01 60.91 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.842 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -75.58 -54.52 6.87 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 122.374 0.269 . . . . 0.0 111.446 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.53 168.32 7.58 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.19 9.29 15.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.027 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.453 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 73.2 m -161.15 153.81 20.66 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 175.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.539 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.39 -39.58 74.46 Favored 'General case' 0 C--O 1.182 -2.472 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.461 -177.802 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.453 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 2.8 p-10 -62.78 -32.47 73.64 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 124.545 1.138 . . . . 0.0 109.479 176.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -71.96 -46.72 56.4 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.156 174.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.45 99.17 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.58 -49.06 77.63 Favored 'General case' 0 C--O 1.196 -1.731 0 C-N-CA 125.235 1.414 . . . . 0.0 109.381 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -66.12 -48.39 71.0 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 122.535 0.334 . . . . 0.0 111.669 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.444 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.8 pp -69.35 -29.96 67.88 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.642 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.548 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.93 -37.41 58.75 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.686 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.578 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.04 -35.93 80.09 Favored 'General case' 0 C--O 1.204 -1.317 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 7.2 mm-40 -59.89 -52.04 67.13 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.803 0.841 . . . . 0.0 110.263 172.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.73 -47.74 84.46 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.398 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.618 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.3 tt -68.16 -37.23 77.8 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.157 -177.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 13.0 t80 -56.88 -54.11 50.28 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 125.269 1.428 . . . . 0.0 111.395 176.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.4 ptpt -66.23 -32.28 73.61 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.411 -177.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.46 -39.54 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.684 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.0 mt-30 -66.2 -46.45 77.25 Favored 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.922 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.642 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.1 ptpt -75.2 -27.99 59.82 Favored 'General case' 0 N--CA 1.401 -2.92 0 C-N-CA 119.41 -0.916 . . . . 0.0 112.369 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 10.5 tp10 -57.54 -52.89 63.57 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.525 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -66.59 -41.55 88.33 Favored 'General case' 0 C--O 1.25 1.101 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.77 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' N ' HD12 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -60.77 -53.8 52.92 Favored 'General case' 0 N--CA 1.416 -2.165 0 C-N-CA 123.251 0.62 . . . . 0.0 110.433 -177.63 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -73.35 -32.31 64.46 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -175.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.428 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.245 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.442 -0.852 0 CA-C-O 121.476 0.655 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.57 -45.94 56.77 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.845 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.48 -42.94 97.31 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.24 -47.6 79.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.426 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.98 -44.16 82.4 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.75 0.656 . . . . 0.0 109.624 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.48 -60.62 3.5 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.867 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 17.5 m -57.05 -48.79 77.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.86 0.362 . . . . 0.0 111.837 -173.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 m -69.94 -52.61 23.03 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.047 -174.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.18 -40.88 59.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.566 -174.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.596 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 33.1 t . . . . . 0 N--CA 1.464 0.262 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.525 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 14.5 tpt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.528 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.0 mt-10 -48.98 -26.86 2.76 Favored 'General case' 0 C--O 1.187 -2.234 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 177.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.4 m -62.04 -60.33 3.77 Favored 'General case' 0 C--O 1.27 2.134 0 CA-C-N 119.391 0.996 . . . . 0.0 111.249 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.522 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.7 pp -72.53 -25.53 22.95 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 CA-C-O 122.492 1.139 . . . . 0.0 110.532 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.595 ' CG2' HD11 ' A' ' 26' ' ' ILE . 5.9 mm -70.48 -37.58 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.093 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.431 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.489 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 32.3 ttm180 -64.32 -36.55 84.48 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 m -57.83 -49.02 78.08 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.186 173.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -68.62 -41.63 79.21 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.489 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -77.27 -20.41 55.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--N 1.321 -0.632 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.743 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.373 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -75.74 -18.56 59.52 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.389 19.6 p80 -72.32 -0.52 12.53 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -174.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -90.56 -6.32 54.85 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.152 0.501 . . . . 0.0 109.878 173.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -106.72 11.99 29.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.206 0.527 . . . . 0.0 112.136 -176.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.474 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.7 p -129.05 109.9 19.67 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 CA-C-O 122.119 0.961 . . . . 0.0 109.51 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.0 m -73.87 150.74 40.75 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.842 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.66 -38.36 84.64 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -61.29 -37.25 82.5 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.592 176.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.435 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -73.35 -45.51 54.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -173.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.546 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -70.41 -43.35 70.16 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.199 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.4 t -65.77 -28.07 68.75 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -64.97 -48.22 74.78 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.466 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -60.56 -38.75 85.57 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.823 177.415 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.0 t -57.46 -47.34 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.121 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.552 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.2 t-80 -62.98 -38.65 92.0 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.798 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.9 -35.6 77.04 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 119.11 -1.036 . . . . 0.0 111.538 175.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.58 -42.29 78.42 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.5 t -58.59 -50.25 79.67 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.713 173.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.4 mt-30 -62.52 -30.49 71.33 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.856 0.36 . . . . 0.0 111.64 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.35 -43.42 21.17 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.494 HG13 HG12 ' B' ' 145' ' ' ILE . 3.1 tt -70.68 -32.96 51.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.953 0.882 . . . . 0.0 109.62 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.428 ' HE1' ' NH1' ' A' ' 39' ' ' ARG . 79.1 t80 -125.37 84.96 59.13 Favored Pre-proline 0 N--CA 1.407 -2.594 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.531 -176.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -59.66 85.38 0.07 OUTLIER 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 123.073 2.516 . . . . 0.0 108.804 168.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -63.75 140.61 97.85 Favored Pre-proline 0 N--CA 1.424 -1.744 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -170.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.4 -21.19 6.52 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.945 2.43 . . . . 0.0 111.532 174.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -153.68 135.16 8.75 Favored Pre-proline 0 CA--C 1.505 -0.759 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -53.47 -24.25 27.68 Favored 'Trans proline' 0 CA--C 1.558 1.713 0 C-N-CA 122.726 2.284 . . . . 0.0 113.812 175.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.15 -14.7 59.36 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.826 -0.546 . . . . 0.0 111.68 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.66 -10.95 59.87 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.934 0.873 . . . . 0.0 109.494 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.2 mt -85.32 3.01 41.66 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.371 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.76 15.18 4.36 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.762 0.792 . . . . 0.0 110.052 177.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 36.3 t70 -74.93 175.63 7.91 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.947 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.06 -21.66 62.22 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.477 0.656 . . . . 0.0 110.417 178.237 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.428 ' NH1' ' HE1' ' A' ' 27' ' ' PHE . 60.0 ttt180 -75.52 -16.0 60.33 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.567 0.699 . . . . 0.0 109.2 176.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.662 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.58 -40.9 93.26 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.456 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -58.48 -32.13 68.48 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.233 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -72.02 -49.67 34.93 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 124.27 1.028 . . . . 0.0 110.774 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.71 -43.32 84.65 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.867 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.662 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -73.36 -28.05 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.25 -49.93 75.09 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.428 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -57.83 -46.16 85.13 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.998 175.336 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.31 90.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.512 0.196 . . . . 0.0 111.456 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -63.17 -44.62 94.93 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.205 0.602 . . . . 0.0 112.182 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.1 pttp -68.22 -36.95 80.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.188 0.518 . . . . 0.0 110.111 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.2 t -66.99 -47.72 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.612 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -55.52 -49.79 71.7 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.655 0.782 . . . . 0.0 108.999 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.44 84.84 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.922 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.12 -54.69 22.39 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.617 -0.343 . . . . 0.0 110.728 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.462 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.8 OUTLIER -66.78 -27.53 67.66 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.449 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.33 -53.75 47.73 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -67.7 -34.31 76.62 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.35 0.595 . . . . 0.0 111.574 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 33.8 m -68.53 -24.51 64.66 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.31 161.25 14.76 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -107.5 5.4 27.11 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.65 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.8 p -163.98 157.53 18.59 Favored 'General case' 0 CA--C 1.477 -1.833 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.27 -28.55 63.19 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.126 -178.677 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -67.06 -40.11 87.03 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -64.17 -45.27 89.15 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.463 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -43.6 92.95 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.889 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.693 ' CE1' HD13 ' B' ' 115' ' ' LEU . 10.9 t80 -60.68 -47.43 86.29 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.505 1.122 . . . . 0.0 109.944 178.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -63.38 -50.58 69.33 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.3 pp -70.55 -30.23 66.9 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.653 -175.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.408 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.8 OUTLIER -70.51 -43.28 69.98 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.52 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.562 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -55.34 -41.23 72.21 Favored 'General case' 0 C--O 1.202 -1.418 0 O-C-N 123.795 0.684 . . . . 0.0 110.795 173.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -56.96 -49.66 75.0 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 123.399 0.679 . . . . 0.0 111.718 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -36.3 68.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.573 -177.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.562 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.7 tt -69.61 -35.69 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.4 t80 -56.65 -52.5 64.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.975 1.31 . . . . 0.0 110.593 175.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.02 -32.4 73.6 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.375 -177.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.37 -43.01 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 O-C-N 123.244 0.34 . . . . 0.0 110.743 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.9 mt-30 -63.06 -52.71 61.71 Favored 'General case' 0 CA--C 1.491 -1.311 0 O-C-N 123.757 0.661 . . . . 0.0 110.679 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.8 ptpt -72.39 -27.93 62.68 Favored 'General case' 0 N--CA 1.409 -2.493 0 C-N-CA 119.184 -1.006 . . . . 0.0 112.908 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 40.4 tp10 -57.48 -52.89 63.56 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.1 -43.18 75.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.591 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -61.63 -52.93 62.32 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.9 pt-20 -71.46 -32.67 68.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.411 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.198 0.523 . . . . 0.0 110.458 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.549 0.91 0 CA-C-O 120.818 0.342 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.41 -45.65 53.31 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.688 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -64.22 -40.81 96.81 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.096 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.36 -40.85 85.8 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.634 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 67.8 tp -56.28 -53.69 54.2 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.693 HD13 ' CE1' ' A' ' 65' ' ' TYR . 26.4 mt -51.59 -65.24 0.59 Allowed 'General case' 0 C--O 1.205 -1.261 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.274 176.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.7 m -59.37 -31.8 69.55 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.96 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 56.7 m -69.1 -47.89 63.99 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.124 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -76.5 -34.41 58.61 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.868 -176.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 66.7 p . . . . . 0 C--O 1.243 0.74 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -174.949 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.512 ' SD ' HD11 ' B' ' 144' ' ' ILE . 9.7 tpt . . . . . 0 CA--C 1.552 1.021 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.433 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 51.3 mt-10 -54.78 -25.82 30.57 Favored 'General case' 0 C--O 1.194 -1.823 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.5 p -63.57 -59.82 4.13 Favored 'General case' 0 C--O 1.265 1.914 0 CA-C-N 119.54 1.064 . . . . 0.0 110.859 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' B' ' 141' ' ' MET . 9.0 pt -61.92 -35.41 67.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.736 0.779 . . . . 0.0 109.911 176.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.494 HG12 HG13 ' A' ' 26' ' ' ILE . 1.4 mp -67.91 -34.29 66.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.069 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 146' ' ' ARG . 21.6 ttt180 -65.18 -47.53 76.64 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 8.8 p -63.53 -33.91 76.64 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.987 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -80.68 -35.64 33.39 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -74.49 -23.59 58.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.023 0.374 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 59.7 ttp . . . . . 0 N--CA 1.463 0.213 0 O-C-N 123.976 0.797 . . . . 0.0 109.605 176.849 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.536 0 N-CA-C 115.052 0.781 . . . . 0.0 115.052 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -73.27 -9.13 58.38 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 117.392 0.596 . . . . 0.0 111.309 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -57.62 -21.94 42.46 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 121.475 0.655 . . . . 0.0 112.099 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.8 -19.51 58.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.557 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -94.57 4.07 54.31 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.716 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -130.64 109.48 17.05 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 178.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 m -74.86 154.36 38.27 Favored 'General case' 0 N--CA 1.413 -2.279 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -52.06 -38.37 56.91 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.718 0.636 . . . . 0.0 110.261 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.684 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 13.9 t70 -60.41 -44.04 96.11 Favored 'General case' 0 C--O 1.179 -2.64 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.684 177.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.561 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.1 tm? -67.68 -51.58 47.98 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -171.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.561 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -60.38 -45.73 92.49 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.071 177.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.2 t -68.02 -22.25 64.98 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.953 0.882 . . . . 0.0 109.584 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.711 ' NE2' ' HA ' ' B' ' 119' ' ' SER . 2.1 t60 -71.61 -43.03 66.93 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.836 -1.074 . . . . 0.0 108.434 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -68.56 -33.6 74.37 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.735 176.013 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 15' ' ' ARG . 92.9 t -56.37 -48.14 80.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 O-C-N 123.773 0.671 . . . . 0.0 109.656 176.067 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.469 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 18.4 t-80 -66.2 -36.92 84.31 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.594 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -66.56 -35.24 79.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.89 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.8 mt -56.23 -46.04 79.7 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 175.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.9 t -57.32 -50.91 75.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 O-C-N 124.052 0.845 . . . . 0.0 111.165 173.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 68.6 mt-30 -60.57 -32.66 71.74 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.477 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -78.33 -46.18 20.75 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.959 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.599 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -70.28 -35.21 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.868 0.842 . . . . 0.0 109.621 -177.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 2.0 m-85 -127.01 90.78 48.57 Favored Pre-proline 0 N--CA 1.402 -2.844 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.89 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 23.8 Cg_endo -64.98 95.14 0.24 Allowed 'Trans proline' 0 N--CA 1.443 -1.484 0 C-N-CA 121.788 1.659 . . . . 0.0 108.207 174.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.449 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 9.9 t -68.87 136.36 89.91 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.798 -170.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.82 -25.36 10.7 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.213 2.608 . . . . 0.0 111.482 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -149.15 144.49 18.07 Favored Pre-proline 0 CA--C 1.49 -1.361 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.41 -13.45 33.0 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.286 1.991 . . . . 0.0 112.575 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.99 -9.33 58.75 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.0 -0.438 . . . . 0.0 111.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.449 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -79.76 -12.24 59.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.884 0.85 . . . . 0.0 109.034 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.458 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.3 mt -85.36 5.98 28.43 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.944 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.03 20.66 4.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.626 0.727 . . . . 0.0 109.736 177.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.61 ' O ' ' HB3' ' A' ' 40' ' ' MET . 23.4 t70 -81.65 175.94 10.06 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.85 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.574 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -71.17 -29.82 65.66 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.891 -0.506 . . . . 0.0 111.252 174.256 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -66.16 -23.45 66.47 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.945 0.879 . . . . 0.0 109.158 177.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -60.38 -36.78 78.88 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.951 176.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.8 pt-20 -61.46 -37.29 83.05 Favored 'General case' 0 C--O 1.2 -1.542 0 C-N-CA 118.444 -1.302 . . . . 0.0 109.672 -178.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -70.7 -43.04 69.84 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.727 0.811 . . . . 0.0 111.17 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.28 -43.82 73.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.641 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.645 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.3 p -73.3 -30.83 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.11 87.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 175.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.542 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.4 t80 -59.41 -46.78 87.74 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.546 175.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.39 -44.9 93.4 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.182 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -64.11 -42.8 96.74 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 122.938 0.495 . . . . 0.0 111.869 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 35.9 pttt -67.98 -40.13 83.18 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 -178.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 54' ' ' MET . 37.7 t -64.15 -50.47 76.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.933 178.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -56.19 -48.5 76.27 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.983 0.802 . . . . 0.0 109.24 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.86 96.28 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.079 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -60.25 -54.31 47.23 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.403 0.62 . . . . 0.0 110.034 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.519 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.3 ptp -67.76 -31.21 70.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.24 -35.72 80.13 Favored 'General case' 0 C--O 1.202 -1.432 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -20.57 37.3 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 121.296 -0.877 . . . . 0.0 111.748 177.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.3 t -80.65 -49.01 11.8 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.54 164.49 13.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -102.57 -5.01 24.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.988 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.2 m -157.81 154.17 27.64 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -63.6 -33.55 75.86 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.493 178.363 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -56.31 -47.49 78.59 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.44 0.638 . . . . 0.0 109.536 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.71 -45.03 80.05 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.753 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -41.01 98.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.636 ' CE1' HD13 ' B' ' 115' ' ' LEU . 8.5 t80 -63.19 -48.47 78.21 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.336 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m80 -67.25 -44.8 78.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -70.27 -30.57 67.63 Favored 'General case' 0 C--O 1.254 1.341 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.157 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.27 -41.09 67.12 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -58.3 -35.09 71.32 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.616 0.767 . . . . 0.0 111.57 176.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 32.3 mm-40 -70.08 -42.86 72.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.055 0.455 . . . . 0.0 111.122 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.54 -39.51 70.64 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.723 -179.327 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.627 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -67.29 -34.64 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.509 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 2.7 t80 -53.75 -50.88 65.03 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 124.856 1.263 . . . . 0.0 110.756 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.0 ptpt -66.73 -33.66 76.13 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.5 0.5 . . . . 0.0 110.77 -176.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.31 -45.35 98.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.6 mt-30 -59.71 -46.52 88.85 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.777 -176.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -79.03 -27.01 43.16 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -59.97 -46.08 90.6 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.704 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.2 pp -68.81 -40.65 79.43 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.127 178.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 47.3 mt-10 -55.57 -52.75 62.7 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 121.11 0.481 . . . . 0.0 110.818 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.3 pt-20 -67.1 -39.38 86.7 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.206 -176.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.775 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.344 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.441 HG23 HD22 ' B' ' 111' ' ' LEU . 6.5 t . . . . . 0 N--CA 1.443 -0.804 0 CA-C-O 121.054 0.454 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' LEU . . . . . 0.441 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -71.13 -41.81 70.03 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -67.98 -40.92 83.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.33 -178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.84 -47.99 83.86 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.585 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 tt -55.54 -49.77 71.79 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.636 HD13 ' CE1' ' A' ' 65' ' ' TYR . 51.8 mt -55.89 -67.54 0.28 Allowed 'General case' 0 C--O 1.21 -1.025 0 O-C-N 124.287 0.992 . . . . 0.0 111.451 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 22.5 m -58.82 -38.33 78.42 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.694 -169.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.8 m -69.76 -51.77 31.15 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.047 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.54 -33.63 58.55 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.517 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.711 ' HA ' ' NE2' ' A' ' 17' ' ' HIS . 22.6 t . . . . . 0 C--O 1.246 0.894 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.704 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.0 ttt . . . . . 0 N--CA 1.446 -0.654 0 CA-C-O 120.383 0.135 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.584 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.9 mt-10 -54.48 -27.18 36.0 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -61.32 -51.0 70.66 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.013 0.435 . . . . 0.0 110.668 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -75.34 -24.35 17.38 Favored 'Isoleucine or valine' 0 C--O 1.249 1.049 0 CA-C-O 122.015 0.912 . . . . 0.0 110.764 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.599 ' CG2' HD11 ' A' ' 26' ' ' ILE . 16.1 mm -65.94 -42.24 91.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.776 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -60.37 -40.17 89.87 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 123.861 0.864 . . . . 0.0 108.906 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.2 m -56.12 -45.93 79.33 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 123.553 0.533 . . . . 0.0 110.017 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -71.02 -50.07 38.12 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.2 pp -71.69 -31.5 66.83 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -173.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 150' ' ' MET . . . . . 0.454 ' N ' HD12 ' B' ' 149' ' ' LEU . 16.4 tpt . . . . . 0 C--N 1.309 -1.188 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.215 0 N-CA-C 115.679 1.032 . . . . 0.0 115.679 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -69.51 -11.27 60.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 117.601 0.701 . . . . 0.0 111.094 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -60.23 -23.03 63.73 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.936 0.398 . . . . 0.0 111.471 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -79.88 -6.55 57.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.3 0.572 . . . . 0.0 110.512 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -101.05 9.56 42.01 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.788 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.717 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -126.19 111.28 26.05 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.265 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 177.703 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -73.19 150.16 42.33 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.7 tm0? -52.65 -37.99 59.54 Favored 'General case' 0 N--CA 1.441 -0.892 0 O-C-N 123.798 0.686 . . . . 0.0 110.075 176.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 12.4 m-20 -53.17 -44.75 68.11 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 175.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.596 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.57 -54.14 9.99 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 -170.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.1 ptm180 -59.79 -45.27 92.81 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 t -69.68 -25.56 63.95 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.484 0.659 . . . . 0.0 109.947 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.649 ' CE1' ' HA ' ' B' ' 119' ' ' SER . 19.5 t60 -65.92 -46.53 77.88 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.219 176.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -65.87 -34.5 78.29 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.259 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.4 t -55.35 -47.32 78.14 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 CA-C-O 121.33 0.586 . . . . 0.0 109.736 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.48 -37.37 82.8 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.145 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.597 ' HZ3' ' CE1' ' A' ' 17' ' ' HIS . 12.6 mptt -64.54 -37.62 88.18 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.802 175.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 94.1 mt -56.67 -45.08 81.91 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.402 HG11 ' HE3' ' A' ' 40' ' ' MET . 55.6 t -60.4 -53.84 43.26 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 O-C-N 123.508 0.505 . . . . 0.0 110.491 173.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -53.22 -34.72 58.27 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.607 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -79.32 -46.15 18.25 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.675 HD11 HG23 ' B' ' 145' ' ' ILE . 5.5 tt -71.07 -33.25 50.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.311 0.577 . . . . 0.0 110.708 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.418 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 82.6 t80 -124.25 95.4 43.63 Favored Pre-proline 0 N--CA 1.409 -2.516 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.808 -176.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 29.2 Cg_endo -62.37 109.56 0.88 Allowed 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.478 2.118 . . . . 0.0 110.414 173.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.46 HG21 HD21 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -72.82 119.58 76.15 Favored Pre-proline 0 N--CA 1.397 -3.091 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.278 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.6 -15.19 11.11 Favored 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 122.398 2.065 . . . . 0.0 110.844 176.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.13 143.31 4.4 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.483 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.9 Cg_endo -59.88 -21.0 62.41 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.251 1.967 . . . . 0.0 113.346 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.13 -10.91 60.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.49 -0.756 . . . . 0.0 111.393 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.8 -13.93 59.97 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.682 0.753 . . . . 0.0 110.054 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 32' ' ' PRO . 7.7 mt -88.41 5.34 42.72 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.172 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -133.66 20.42 3.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.892 0.854 . . . . 0.0 109.537 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.649 ' O ' ' HB3' ' A' ' 40' ' ' MET . 13.7 t70 -80.58 172.91 13.15 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.865 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.609 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -72.06 -26.48 62.2 Favored 'General case' 0 C--N 1.309 -1.172 0 O-C-N 121.592 -0.693 . . . . 0.0 110.455 175.259 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -67.57 -25.8 65.97 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.649 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 3.0 tpp -59.92 -41.14 91.08 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.902 -1.044 . . . . 0.0 112.248 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 9.7 pt-20 -64.94 -27.9 69.15 Favored 'General case' 0 C--O 1.206 -1.229 0 C-N-CA 118.648 -1.221 . . . . 0.0 109.916 -177.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -74.03 -45.08 51.97 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.117 0.967 . . . . 0.0 110.337 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.99 -41.38 77.92 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.711 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.551 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.7 p -73.49 -30.47 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.29 -44.13 95.65 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 7.0 t80 -60.02 -51.09 71.14 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.203 172.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.21 -43.33 87.61 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.021 0.439 . . . . 0.0 111.223 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -66.25 -46.74 76.05 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 123.571 0.749 . . . . 0.0 111.838 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 12.5 pttp -63.79 -37.0 85.73 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.506 ' O ' ' HG2' ' A' ' 54' ' ' MET . 21.8 t -69.2 -53.15 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.295 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 55' ' ' TYR . 13.5 tm-20 -54.35 -50.5 67.3 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 124.198 0.936 . . . . 0.0 109.718 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.07 99.43 Favored Glycine 0 C--O 1.222 -0.651 0 O-C-N 123.576 0.547 . . . . 0.0 112.441 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -59.38 -52.2 66.64 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.227 0.537 . . . . 0.0 111.374 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.533 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.5 ptp -71.45 -27.51 63.31 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 40.9 t80 -64.26 -47.45 79.56 Favored 'General case' 0 C--O 1.206 -1.215 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 176.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -71.89 -25.71 62.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.26 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.5 t -80.84 -24.92 38.1 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.18 168.97 12.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -109.58 4.72 22.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.653 178.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.8 p -168.95 153.47 5.7 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.717 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -64.74 -33.83 76.9 Favored 'General case' 0 C--O 1.189 -2.109 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.812 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.77 -27.25 63.78 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.276 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.539 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 6.5 tp10 -75.32 -44.68 44.08 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 173.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -39.38 93.62 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.764 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.721 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 5.2 t80 -65.3 -46.99 78.18 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.069 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -56.4 -57.42 12.38 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 124.2 1.0 . . . . 0.0 111.697 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.9 pp -69.15 -30.32 68.53 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.52 -39.56 64.7 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.005 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.69 -38.8 82.57 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.091 176.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.69 -44.07 94.77 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -36.85 72.76 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 119.327 -0.949 . . . . 0.0 111.361 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.596 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.2 tt -69.98 -39.35 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.1 t80 -52.19 -53.29 45.1 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.073 1.349 . . . . 0.0 111.067 174.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -66.33 -34.01 77.02 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.007 -176.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.68 -42.84 93.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 O-C-N 123.426 0.454 . . . . 0.0 111.221 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.607 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 47.9 mt-30 -61.21 -48.77 79.99 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 121.414 0.625 . . . . 0.0 110.345 -178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.7 ptpt -74.93 -27.7 60.31 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.506 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -61.31 -47.78 84.4 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.41 ' HB3' ' HG3' ' B' ' 141' ' ' MET . 4.4 pp -69.78 -36.91 76.13 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.465 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.7 OUTLIER -61.72 -53.36 57.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.199 0.6 . . . . 0.0 110.96 179.426 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -73.01 -37.38 66.97 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -176.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HE2' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.589 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.215 -175.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.422 -1.871 0 CA-C-O 120.357 0.122 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.83 -57.81 11.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.614 0.571 . . . . 0.0 112.237 -178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -69.19 -36.67 77.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.611 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -64.71 -47.9 76.63 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.261 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.02 -47.59 85.21 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.439 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.721 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 18.3 mt -51.57 -66.41 0.39 Allowed 'General case' 0 C--O 1.214 -0.771 0 O-C-N 124.131 0.895 . . . . 0.0 111.738 177.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 15.0 t -62.56 -35.54 79.81 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -169.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -76.57 -44.35 35.04 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.304 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -76.14 -27.79 57.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.077 0.465 . . . . 0.0 110.642 -175.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.649 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 19.8 t . . . . . 0 C--N 1.313 -1.009 0 C-N-CA 120.498 -0.481 . . . . 0.0 112.064 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.429 ' O ' HG12 ' B' ' 145' ' ' ILE . 92.1 mmm . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.673 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 44.9 mt-10 -47.63 -29.85 3.26 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -173.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 35.0 t -59.3 -59.6 5.2 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 120.878 0.37 . . . . 0.0 110.299 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -70.54 -24.32 25.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.615 0.722 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 26' ' ' ILE . 13.3 mm -66.45 -49.95 71.19 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.604 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 19.1 mtp180 -66.25 -34.89 79.04 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 120.48 0.181 . . . . 0.0 110.902 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 t -57.22 -43.02 82.43 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 123.935 0.772 . . . . 0.0 109.111 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -77.1 -54.92 5.92 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.188 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.616 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.3 pp -65.17 -26.64 68.25 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 -172.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' MET . . . . . 0.4 ' N ' HD12 ' B' ' 149' ' ' LEU . 15.6 tpt . . . . . 0 C--N 1.308 -1.238 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.379 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.456 0 N-CA-C 115.107 0.803 . . . . 0.0 115.107 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.3 p-90 -67.48 -7.29 24.41 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -55.84 -30.36 61.33 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.024 0.44 . . . . 0.0 111.354 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -75.84 -10.46 59.45 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.046 0.45 . . . . 0.0 111.173 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -106.78 11.98 29.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.205 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.508 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.3 p -128.38 112.2 26.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 121.753 0.787 . . . . 0.0 109.685 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -74.62 150.07 39.78 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.963 -175.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -59.24 -41.98 90.01 Favored 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -65.02 -29.4 70.31 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.384 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -74.41 -52.34 12.37 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 -177.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.3 ptm180 -65.87 -42.29 90.56 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.57 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -69.68 -25.83 64.08 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CD2' ' HB3' ' B' ' 119' ' ' SER . 73.0 t60 -66.73 -45.31 79.07 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 121.41 0.624 . . . . 0.0 109.599 175.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.704 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -62.7 -36.8 84.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.232 177.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -60.78 -48.75 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.318 0.647 . . . . 0.0 109.65 173.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.487 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 33.0 t-80 -55.12 -45.18 75.54 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.32 0.648 . . . . 0.0 110.767 177.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -66.39 -37.87 86.22 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.871 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.98 -43.16 86.39 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 18.6 t -54.55 -49.64 64.91 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 C-N-CA 123.964 0.906 . . . . 0.0 111.0 173.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.95 -15.93 61.1 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.655 -0.818 . . . . 0.0 113.112 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.08 -45.67 16.14 Favored 'General case' 0 C--O 1.208 -1.107 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.46 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.563 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.8 tt -70.53 -30.47 42.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 122.417 1.103 . . . . 0.0 109.885 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -134.85 83.37 41.13 Favored Pre-proline 0 N--CA 1.399 -3.007 0 CA-C-N 114.192 -1.367 . . . . 0.0 107.872 -176.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.78 94.0 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.381 2.054 . . . . 0.0 108.284 170.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 t -63.78 126.99 91.0 Favored Pre-proline 0 N--CA 1.414 -2.263 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.862 -169.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -72.75 -26.4 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.78 2.32 . . . . 0.0 111.298 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.4 142.47 14.62 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.88 -25.14 34.11 Favored 'Trans proline' 0 CA--C 1.554 1.485 0 C-N-CA 122.562 2.175 . . . . 0.0 114.559 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.64 -10.81 59.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.258 -0.902 . . . . 0.0 111.82 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.55 59.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.577 0.703 . . . . 0.0 109.914 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.438 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -87.5 0.38 55.64 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.089 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.86 34.37 3.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 122.002 0.906 . . . . 0.0 110.681 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.662 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.0 t70 -95.32 177.25 5.91 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.454 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.662 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.01 -25.67 62.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 121.723 -0.611 . . . . 0.0 109.778 176.909 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.5 ttm180 -66.24 -24.57 66.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.556 175.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.583 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 6.1 tpp -60.57 -43.74 96.95 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.54 -0.754 . . . . 0.0 112.38 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HA ' HG12 ' A' ' 44' ' ' VAL . 11.3 pt-20 -67.56 -26.43 66.3 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 118.603 -1.239 . . . . 0.0 110.297 -177.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -73.1 -44.89 59.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.744 177.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 77.6 mt -69.78 -41.03 75.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.578 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 41' ' ' GLU . 3.6 p -71.77 -28.18 29.98 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.668 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.2 87.04 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.273 0.559 . . . . 0.0 109.545 175.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.0 t80 -60.95 -45.87 92.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.294 174.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.84 97.92 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.418 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -62.56 -45.62 92.11 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.571 0.749 . . . . 0.0 112.225 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 12.7 pttp -63.91 -37.39 87.21 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.354 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 51.0 t -72.22 -47.71 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.321 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.74 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.12 -45.24 91.41 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.004 0.922 . . . . 0.0 109.863 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.88 -42.15 99.71 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.937 177.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.97 -54.11 50.59 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.376 0.27 . . . . 0.0 111.32 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.462 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -67.23 -30.98 71.03 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.401 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -59.31 -49.59 77.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -77.34 -21.67 53.01 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.324 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -80.97 -35.9 31.54 Favored 'General case' 0 CA--C 1.553 1.075 0 CA-C-O 120.609 0.242 . . . . 0.0 111.498 -178.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.58 167.84 16.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.133 0.492 . . . . 0.0 111.499 -178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -121.83 15.1 10.9 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.639 0.733 . . . . 0.0 110.503 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.5 m -156.0 148.92 24.2 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.508 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -68.04 -39.75 83.0 Favored 'General case' 0 C--O 1.191 -1.997 0 CA-C-O 121.034 0.445 . . . . 0.0 111.542 -179.737 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -67.71 -32.87 73.81 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 123.627 0.771 . . . . 0.0 108.982 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.56 -48.05 70.89 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.617 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -41.28 98.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.565 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -49.26 77.91 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.819 1.248 . . . . 0.0 109.764 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 32.6 m170 -64.1 -49.03 73.85 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.419 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.2 pp -69.62 -30.45 68.18 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.75 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.704 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -74.56 -35.99 63.08 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.906 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.524 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.62 -31.79 73.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.1 mm-40 -71.57 -43.2 66.75 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.035 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -71.41 -36.29 71.29 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.331 -179.085 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.592 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.4 tt -67.23 -39.78 83.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.5 t80 -55.24 -54.66 40.61 Favored 'General case' 0 C--O 1.262 1.716 0 C-N-CA 124.491 1.116 . . . . 0.0 111.291 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 18.1 ptpt -64.42 -34.67 78.73 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.229 -177.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.14 -40.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 O-C-N 123.395 0.434 . . . . 0.0 111.187 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.1 mt-30 -65.76 -52.49 50.57 Favored 'General case' 0 CA--C 1.489 -1.375 0 CA-C-O 121.504 0.669 . . . . 0.0 110.471 -177.11 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -72.18 -27.93 62.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.31 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -61.62 -51.97 66.3 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 123.635 0.584 . . . . 0.0 109.631 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -62.39 -40.31 96.07 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.489 -178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.412 ' N ' HD12 ' A' ' 79' ' ' LEU . 3.4 tm-20 -62.62 -49.74 73.98 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 123.366 0.666 . . . . 0.0 110.468 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -75.01 -35.49 61.97 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.786 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.572 177.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.431 HG23 HD22 ' B' ' 111' ' ' LEU . 5.1 t . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' LEU . . . . . 0.431 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -73.35 -46.48 48.92 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.226 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -59.22 -42.24 90.53 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 120.967 0.413 . . . . 0.0 110.596 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.48 -43.59 89.75 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.851 176.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -55.96 -49.44 73.53 Favored 'General case' 0 C--O 1.264 1.823 0 CA-C-O 121.42 0.628 . . . . 0.0 109.868 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.423 HD23 ' O ' ' B' ' 111' ' ' LEU . 4.1 mm? -53.51 -54.61 34.79 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.302 176.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 33.6 m -60.85 -43.16 98.7 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.273 0.983 . . . . 0.0 110.481 -176.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 40.2 t -58.45 -49.55 76.93 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.414 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -77.13 -52.48 9.2 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 117.679 -1.608 . . . . 0.0 112.828 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.498 ' HB3' ' CD2' ' A' ' 17' ' ' HIS . 77.6 p . . . . . 0 C--N 1.318 -0.795 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.462 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.0 ttt . . . . . 0 N--CA 1.442 -0.86 0 CA-C-O 120.898 0.38 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.635 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.282 21.0 mt-10 -49.57 -28.03 5.16 Favored 'General case' 0 C--O 1.187 -2.229 0 N-CA-C 116.574 2.064 . . . . 0.0 116.574 -176.415 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 p -54.79 -60.04 3.91 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 119.167 0.894 . . . . 0.0 111.274 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.429 HD11 ' HG3' ' B' ' 141' ' ' MET . 22.1 pt -68.99 -25.47 30.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.753 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.635 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 17.4 mm -70.87 -40.52 76.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.196 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.747 177.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 24.5 mmm180 -60.83 -47.8 84.7 Favored 'General case' 0 CA--C 1.498 -1.019 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.4 p -60.11 -38.25 82.42 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 119.564 -0.854 . . . . 0.0 111.747 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.599 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 55.2 mm-40 -66.17 -57.56 7.36 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 175.52 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.479 HD23 HG22 ' B' ' 145' ' ' ILE . 4.3 pp -61.48 -23.75 66.1 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -173.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 150' ' ' MET . . . . . 0.407 ' HG3' HD12 ' B' ' 149' ' ' LEU . 70.0 mtm . . . . . 0 C--O 1.239 0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.796 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 CA--C 1.524 0.647 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -71.31 -5.68 34.16 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.574 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 25.4 p80 -70.51 -11.89 61.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.91 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 13.1 pt-20 -90.71 -6.83 53.96 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.989 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.8 m80 -95.08 5.88 50.62 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.408 0.683 . . . . 0.0 110.044 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.4 p -133.07 121.46 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 m -77.91 149.88 34.15 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -61.62 -36.1 79.79 Favored 'General case' 0 C--O 1.205 -1.242 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 9.6 m-20 -66.02 -29.26 69.6 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.2 tm? -73.22 -51.55 17.29 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -177.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.518 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.3 ptm180 -65.14 -43.07 93.05 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.106 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.43 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 38.9 t -64.68 -28.83 69.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 121.464 0.649 . . . . 0.0 109.288 178.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -67.23 -43.86 80.93 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.637 176.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.501 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -63.46 -37.45 87.33 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.313 176.833 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 15' ' ' ARG . 89.7 t -55.03 -47.05 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.423 0.689 . . . . 0.0 109.595 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.462 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 13.2 t-80 -63.31 -37.05 85.75 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.313 178.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.66 -32.65 66.0 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 118.891 -1.124 . . . . 0.0 111.783 176.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.4 mt -57.06 -43.68 82.27 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 173.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 23.4 t -57.63 -46.79 86.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.1 172.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 34.6 mt-30 -69.96 -31.16 68.73 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.529 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -73.36 -45.9 52.31 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.441 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.3 tt -70.85 -33.74 53.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.393 0.616 . . . . 0.0 110.781 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -127.02 81.74 69.35 Favored Pre-proline 0 N--CA 1.418 -2.074 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.717 -174.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.57 120.15 7.36 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.346 2.697 . . . . 0.0 109.358 169.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.5 112.72 4.54 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 -170.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.38 -12.42 9.12 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 121.82 1.68 . . . . 0.0 108.498 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -176.83 137.56 0.43 Allowed Pre-proline 0 CA--C 1.496 -1.126 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.93 -22.19 73.66 Favored 'Trans proline' 0 N--CA 1.45 -1.061 0 C-N-CA 121.989 1.793 . . . . 0.0 112.158 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.88 -3.47 57.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.914 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.07 -10.72 59.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.107 0.956 . . . . 0.0 108.453 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.84 5.4 25.28 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.627 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.6 16.92 3.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.638 0.733 . . . . 0.0 110.351 175.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.0 t70 -83.19 179.1 7.82 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.806 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -69.86 -26.76 64.36 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.51 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 12.1 ttm180 -68.03 -21.01 65.04 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 9.0 tpp -63.44 -44.01 95.77 Favored 'General case' 0 C--O 1.206 -1.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.315 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.1 pt-20 -62.62 -30.02 71.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 119.347 -0.941 . . . . 0.0 109.73 -177.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.429 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.9 t30 -71.41 -47.65 54.69 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 124.57 1.148 . . . . 0.0 110.309 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 82.5 mt -69.11 -41.8 76.93 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.391 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.509 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -73.32 -27.82 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.78 77.12 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.581 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 3.1 t80 -56.23 -42.41 77.25 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.108 0.563 . . . . 0.0 109.889 173.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.84 -42.52 85.61 Favored 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.083 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -64.44 -42.48 95.97 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.508 0.323 . . . . 0.0 111.638 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.581 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 5.1 ptmt -63.02 -44.81 94.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.244 176.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 52.7 t -63.66 -50.04 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.602 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -56.28 -46.7 79.61 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 109.201 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.559 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . -59.53 -44.06 97.07 Favored Glycine 0 N--CA 1.443 -0.847 0 O-C-N 123.945 0.778 . . . . 0.0 112.335 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.69 -54.36 47.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 122.787 0.435 . . . . 0.0 110.838 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.436 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -68.22 -31.97 71.85 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.129 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.574 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 83.9 t80 -61.74 -46.35 90.01 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 123.703 0.801 . . . . 0.0 109.848 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 52' ' ' GLY . 35.5 mt-10 -80.1 -22.75 41.84 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.016 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.404 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 46.4 m -76.35 -30.61 57.69 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.86 167.27 15.31 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -115.04 7.43 15.5 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.47 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.446 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 70.0 m -159.97 153.66 22.71 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.546 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -71.16 -36.63 72.08 Favored 'General case' 0 C--O 1.179 -2.617 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -177.943 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 5.2 p-10 -70.07 -27.29 64.5 Favored 'General case' 0 C--N 1.29 -1.982 0 C-N-CA 124.17 0.988 . . . . 0.0 108.792 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.46 -46.75 46.42 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.19 99.28 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.501 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 1.2 t80 -55.0 -49.5 71.36 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.317 1.447 . . . . 0.0 109.591 174.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -64.49 -53.97 39.72 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.169 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.436 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -69.03 -30.02 68.3 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.94 -176.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.0 OUTLIER -70.4 -39.53 74.42 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.582 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.02 -34.43 77.56 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 123.567 0.542 . . . . 0.0 110.096 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -71.08 -38.71 72.42 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.636 176.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -76.24 -35.46 58.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 118.976 -1.09 . . . . 0.0 111.236 -179.269 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.616 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.3 tt -67.75 -36.91 77.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.564 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.5 t80 -53.23 -53.01 56.95 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.133 1.373 . . . . 0.0 111.263 174.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.3 ptpt -67.84 -31.97 72.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.784 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.48 -43.38 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 O-C-N 123.402 0.439 . . . . 0.0 110.09 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.2 mt-30 -62.9 -54.28 41.04 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.093 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.4 ptpt -68.54 -27.87 66.48 Favored 'General case' 0 N--CA 1.398 -3.063 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.431 -176.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.7 tm-20 -62.88 -52.57 62.58 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 177.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.516 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -64.31 -38.06 89.69 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.66 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.88 -41.37 87.34 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 123.489 0.493 . . . . 0.0 111.686 178.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.2 pt-20 -72.7 -42.65 63.97 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -178.071 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.469 ' HE2' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.426 -1.636 0 CA-C-O 120.641 0.257 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 111' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 3.2 mm? -63.56 -52.45 61.03 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.209 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -68.79 -44.32 73.86 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.229 -178.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.56 -41.11 98.43 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.353 0.408 . . . . 0.0 110.977 -178.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.49 -45.87 87.81 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 49.1 mt -57.73 -58.55 7.84 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.102 177.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.7 m -55.32 -38.95 69.37 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.307 0.575 . . . . 0.0 111.167 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.2 p -77.63 -43.8 30.32 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.566 -175.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -74.64 -37.62 62.73 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.624 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 68.3 p . . . . . 0 N--CA 1.471 0.615 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -177.991 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.668 ' SD ' HD11 ' B' ' 144' ' ' ILE . 14.0 tpt . . . . . 0 C--O 1.215 -0.753 0 CA-C-O 121.285 0.564 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 24.6 tt0 -53.97 -27.15 29.55 Favored 'General case' 0 CA--C 1.567 1.627 0 C-N-CA 124.793 1.237 . . . . 0.0 112.298 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -63.27 -59.41 4.76 Favored 'General case' 0 C--O 1.276 2.46 0 CA-C-O 121.282 0.563 . . . . 0.0 110.756 178.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.668 HD11 ' SD ' ' B' ' 141' ' ' MET . 46.7 pt -62.95 -28.53 45.23 Favored 'Isoleucine or valine' 0 C--N 1.354 0.773 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 10.6 mm -65.27 -43.69 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.839 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.1 177.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.432 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 74.9 mtt85 -63.55 -40.94 98.3 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 119.97 -0.692 . . . . 0.0 111.689 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.8 p -66.6 -26.21 66.98 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.383 176.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -80.59 -49.82 10.8 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.864 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.7 pp -67.39 -29.22 68.68 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.67 -0.644 . . . . 0.0 111.446 -176.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 39.2 tpp . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.17 -178.49 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.915 0 N-CA-C 114.134 0.413 . . . . 0.0 114.134 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -64.17 -10.06 20.71 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -60.24 -27.71 67.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.992 0.425 . . . . 0.0 111.24 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.59 -5.45 59.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.105 0.478 . . . . 0.0 111.062 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -96.52 -24.75 15.92 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.554 0.692 . . . . 0.0 110.153 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.551 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -96.71 124.36 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.661 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.749 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 m -86.08 151.62 23.54 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.061 -176.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -42.21 78.0 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 122.996 0.519 . . . . 0.0 110.291 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -61.45 -31.74 71.7 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.602 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.64 -52.32 15.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 -174.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.454 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -62.58 -45.99 90.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.96 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 m -67.13 -23.48 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.033 0.444 . . . . 0.0 110.561 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 25.4 t60 -68.59 -45.18 72.71 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.602 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -62.19 -38.69 90.07 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.674 177.539 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.462 ' HA ' HD12 ' A' ' 22' ' ' LEU . 94.2 t -54.72 -47.77 73.27 Favored 'Isoleucine or valine' 0 C--O 1.256 1.4 0 C-N-CA 123.138 0.575 . . . . 0.0 110.235 176.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -58.64 -44.75 90.16 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.132 178.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -71.13 -29.75 65.64 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.025 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.1 mt -56.99 -45.17 83.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 175.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.567 HG11 ' HE1' ' A' ' 40' ' ' MET . 15.3 t -61.95 -51.44 72.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 O-C-N 123.799 0.687 . . . . 0.0 111.436 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -63.97 -25.81 68.3 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.341 -175.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.518 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.34 -45.52 16.04 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.587 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.539 HD11 HG21 ' B' ' 145' ' ' ILE . 3.2 tt -70.57 -31.0 44.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.523 0.677 . . . . 0.0 109.391 -177.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.402 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 1.5 m-85 -127.93 90.43 47.73 Favored Pre-proline 0 N--CA 1.407 -2.616 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.086 -176.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 28.6 Cg_endo -65.09 104.31 0.58 Allowed 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 121.848 1.698 . . . . 0.0 108.156 171.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.43 117.65 17.85 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 118.203 2.668 . . . . 0.0 118.203 -168.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -80.05 -19.52 9.39 Favored 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 122.468 2.112 . . . . 0.0 110.251 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -156.94 144.65 14.02 Favored Pre-proline 0 CA--C 1.483 -1.601 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.95 -12.47 26.1 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.145 1.23 . . . . 0.0 110.167 174.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.04 -13.75 60.9 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.069 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -21.66 63.38 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.67 0.748 . . . . 0.0 109.601 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.41 2.11 54.92 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.346 -178.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -136.09 19.01 3.21 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.529 0.681 . . . . 0.0 110.222 173.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.554 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 18.1 t70 -88.61 -179.37 6.02 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.554 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.88 -28.25 64.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 174.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.6 -23.14 66.76 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.567 ' HE1' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -62.66 -40.61 97.6 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 179.097 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -65.56 -36.97 85.34 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.526 -178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.48 -43.67 93.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.504 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.51 -43.35 63.7 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.168 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.52 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 p -73.47 -34.35 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.812 -179.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.13 95.15 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 175.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -61.54 -48.63 80.14 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.787 173.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.29 96.78 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 96.8 mttt -67.07 -45.04 78.54 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.259 0.624 . . . . 0.0 111.764 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 16.0 pttp -64.69 -40.24 95.06 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 54' ' ' MET . 20.7 t -64.91 -51.43 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.229 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.267 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -54.33 -51.31 65.12 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.932 0.893 . . . . 0.0 109.967 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -36.56 93.59 Favored Glycine 0 CA--C 1.52 0.385 0 CA-C-N 116.295 -0.411 . . . . 0.0 113.131 -179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.86 -54.32 48.39 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.793 0.806 . . . . 0.0 108.829 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.621 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.4 ptp -74.31 -28.43 61.16 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.519 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.4 ' HA ' ' CD1' ' A' ' 64' ' ' TYR . 72.5 t80 -59.23 -52.43 65.71 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 174.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -71.82 -27.86 63.2 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.123 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -71.72 -22.63 61.6 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 122.599 0.36 . . . . 0.0 111.638 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.02 168.31 10.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.446 0.641 . . . . 0.0 112.3 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -121.13 13.85 11.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.469 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -156.71 151.48 25.85 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.551 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.8 -36.5 67.59 Favored 'General case' 0 C--O 1.179 -2.614 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.554 177.527 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.25 -30.52 70.98 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 12.9 tp10 -71.75 -48.08 49.3 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.625 176.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.4 ' CD1' ' HA ' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -61.9 -39.4 91.87 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.602 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.522 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.5 OUTLIER -58.79 -48.23 82.01 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 124.604 1.161 . . . . 0.0 109.131 173.24 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -64.49 -55.62 19.52 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 122.921 0.488 . . . . 0.0 110.375 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.621 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -64.84 -30.45 71.45 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.38 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.55 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -76.1 -38.52 56.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.041 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.08 -36.25 82.96 Favored 'General case' 0 C--O 1.19 -2.069 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.71 -44.22 90.95 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.122 0.969 . . . . 0.0 112.407 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -72.87 -35.31 67.15 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.973 -178.581 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.631 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.5 tt -72.02 -35.67 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.585 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.16 -52.52 60.87 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 125.799 1.64 . . . . 0.0 110.818 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -67.29 -35.1 78.79 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.544 0.528 . . . . 0.0 110.584 -177.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.75 -42.18 95.07 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.6 mt-30 -63.59 -49.6 72.71 Favored 'General case' 0 CA--C 1.492 -1.278 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.1 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.607 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.4 ptpt -73.46 -29.4 62.51 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.939 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.2 tp10 -58.98 -52.45 65.7 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.69 -39.06 84.44 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.942 -178.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.5 OUTLIER -63.39 -52.98 59.36 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.246 -179.382 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.0 pt-20 -69.74 -34.15 73.45 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.347 0.481 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.088 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.445 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 111' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 2.9 mm? -69.61 -52.22 27.99 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.505 -175.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -66.16 -43.98 85.41 Favored 'General case' 0 CA--C 1.503 -0.846 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.199 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.99 -43.96 97.74 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 123.68 0.612 . . . . 0.0 110.814 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.36 -45.02 92.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.119 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 66.5 mt -57.03 -62.95 1.39 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.522 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 12.2 t -60.49 -32.77 71.75 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 120.909 0.385 . . . . 0.0 111.722 -174.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 36.9 m -71.74 -49.14 41.83 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.322 0.582 . . . . 0.0 110.329 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.06 -30.22 58.29 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.536 -175.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.467 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 22.8 t . . . . . 0 C--N 1.318 -0.774 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.484 ' SD ' HD11 ' B' ' 144' ' ' ILE . 11.1 tpt . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.563 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 48.4 mt-10 -53.22 -27.24 20.94 Favored 'General case' 0 C--O 1.202 -1.411 0 C-N-CA 124.823 1.249 . . . . 0.0 113.716 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.9 m -65.07 -57.33 8.9 Favored 'General case' 0 C--O 1.263 1.795 0 CA-C-O 121.274 0.559 . . . . 0.0 110.184 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.484 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.9 pp -72.55 -25.49 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.711 0.767 . . . . 0.0 110.563 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.563 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.6 mm -71.14 -33.5 51.37 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.807 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.459 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -62.53 -44.72 95.66 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -58.61 -50.74 72.72 Favored 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.123 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.01 -47.05 87.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.773 1.229 . . . . 0.0 112.956 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.572 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.2 pp -71.0 -30.89 67.25 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.85 -0.531 . . . . 0.0 111.546 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.502 -178.221 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.62 0 N-CA-C 115.309 0.884 . . . . 0.0 115.309 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.95 -5.04 27.9 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -63.29 -17.27 62.34 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.25 0.547 . . . . 0.0 111.048 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.29 -22.2 61.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.04 0.448 . . . . 0.0 110.393 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -96.45 3.06 53.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -134.07 117.23 24.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.692 0.758 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -97.35 168.38 10.44 Favored 'General case' 0 N--CA 1.402 -2.828 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -56.75 -45.82 81.8 Favored 'General case' 0 C--O 1.198 -1.641 0 O-C-N 124.659 1.225 . . . . 0.0 109.667 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 5.5 p-10 -55.49 -37.46 67.85 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD12 HG23 ' A' ' 10' ' ' VAL . 3.3 tm? -73.4 -48.54 33.11 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.7 ptm180 -69.2 -41.68 76.81 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.447 -177.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -71.78 -23.63 61.61 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.581 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 16.7 t60 -72.34 -39.76 67.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.504 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -67.3 -35.58 79.75 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.847 175.426 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.7 t -58.92 -40.33 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 172.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -62.55 -44.13 97.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.859 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.544 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.6 mptp? -68.89 -35.93 77.47 Favored 'General case' 0 CA--C 1.503 -0.837 0 C-N-CA 120.204 -0.598 . . . . 0.0 112.321 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 19' ' ' VAL . 66.1 mt -54.84 -43.37 72.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.2 t -62.29 -50.44 79.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.55 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -66.01 -22.34 66.45 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.903 -176.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.84 -46.23 14.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 177.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.556 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.6 tt -70.88 -29.33 36.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.604 0 CA-C-O 122.294 1.045 . . . . 0.0 108.891 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -129.05 89.31 48.95 Favored Pre-proline 0 N--CA 1.391 -3.385 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.858 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.89 129.51 33.3 Favored 'Trans proline' 0 N--CA 1.444 -1.395 0 C-N-CA 121.954 1.769 . . . . 0.0 108.446 170.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' HD21 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -86.23 117.54 68.86 Favored Pre-proline 0 N--CA 1.408 -2.547 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -169.079 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -78.43 -23.93 8.18 Favored 'Trans proline' 0 N--CA 1.443 -1.479 0 N-CA-C 108.995 -1.194 . . . . 0.0 108.995 172.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -170.25 145.13 2.23 Favored Pre-proline 0 N--CA 1.44 -0.936 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.423 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.51 -20.39 40.94 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.832 2.355 . . . . 0.0 113.596 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -77.67 -11.52 59.88 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.064 -1.022 . . . . 0.0 112.555 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.17 -6.43 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.74 0.781 . . . . 0.0 109.129 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.2 mt -89.92 7.2 38.52 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.716 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 17.9 ptpt -129.88 15.41 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.93 0.871 . . . . 0.0 109.187 175.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 40' ' ' MET . 27.7 t70 -81.75 176.38 9.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.748 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.82 -27.47 63.9 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.034 0.445 . . . . 0.0 110.718 178.503 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.603 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.1 ttp180 -72.98 -17.1 61.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.632 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 4.4 tpp -63.08 -45.48 91.93 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.138 176.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.06 -31.16 72.24 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.711 -175.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -67.56 -49.18 64.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.375 1.47 . . . . 0.0 110.021 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 76.9 mt -67.78 -44.62 76.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.458 -177.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.4 p -71.81 -30.32 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.346 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.167 -177.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.18 -48.69 80.66 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.559 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.2 t80 -59.06 -46.64 87.74 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.468 174.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.16 95.23 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.583 0.23 . . . . 0.0 110.915 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -63.68 -46.28 86.25 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.367 0.667 . . . . 0.0 112.277 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -61.82 -41.35 97.67 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.41 -51.68 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.331 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -57.62 -48.61 78.96 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.848 0.859 . . . . 0.0 109.723 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.93 -40.25 95.1 Favored Glycine 0 N--CA 1.451 -0.356 0 O-C-N 123.762 0.664 . . . . 0.0 112.619 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.57 -54.87 40.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.351 0.26 . . . . 0.0 111.146 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.492 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.3 OUTLIER -68.68 -29.68 68.19 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -62.42 -48.49 79.45 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -79.43 -16.63 55.83 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.492 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 38.8 m -84.43 -23.32 30.04 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.23 165.74 12.96 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -107.99 2.73 23.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.584 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 80.5 p -162.75 159.61 24.39 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.436 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.33 -35.36 68.58 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.973 -176.945 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.58 -35.31 78.76 Favored 'General case' 0 C--O 1.209 -1.06 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -65.03 -47.05 78.78 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.717 174.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -43.37 98.48 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -57.95 -48.74 79.07 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 124.728 1.211 . . . . 0.0 109.512 175.5 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -64.05 -49.91 70.49 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.291 0.369 . . . . 0.0 111.575 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -70.13 -30.39 67.56 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.932 -177.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.504 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -71.43 -42.21 68.53 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.494 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.31 -35.0 74.58 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 123.363 0.665 . . . . 0.0 110.338 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 5.0 mm-40 -66.82 -48.38 69.13 Favored 'General case' 0 C--O 1.26 1.632 0 C-N-CA 123.444 0.698 . . . . 0.0 112.243 175.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.88 -37.61 70.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.904 -0.718 . . . . 0.0 110.914 -178.045 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.669 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -66.23 -37.75 80.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 6.8 t80 -52.59 -54.05 38.28 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 125.232 1.413 . . . . 0.0 111.193 174.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.2 ptpt -65.46 -32.41 74.0 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.097 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.6 mp -65.41 -43.59 94.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 CA-C-O 120.624 0.25 . . . . 0.0 110.508 177.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 63.7 mt-30 -63.29 -53.83 46.74 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.102 -175.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -70.07 -28.78 65.71 Favored 'General case' 0 N--CA 1.395 -3.214 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.023 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.7 tp10 -59.77 -51.7 68.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.662 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -63.31 -44.42 95.0 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.979 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 7.5 pt-20 -72.05 -40.24 68.51 Favored 'General case' 0 C--O 1.195 -1.808 0 C-N-CA 119.024 -1.071 . . . . 0.0 113.158 -177.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.2 pt-20 -72.8 -32.97 65.94 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 119.497 1.044 . . . . 0.0 111.681 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.493 -1.245 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.401 177.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.435 -1.21 0 CA-C-O 121.154 0.502 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.91 -45.22 75.0 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-O 121.13 0.49 . . . . 0.0 111.168 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -72.85 -28.67 62.67 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.513 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.31 -48.37 82.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 109.251 175.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -57.1 -50.0 74.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.423 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.64 -54.19 48.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.083 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.4 t -65.09 -28.18 69.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.668 0.27 . . . . 0.0 110.913 -176.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.5 m -73.42 -41.59 63.09 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.075 0.464 . . . . 0.0 110.389 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB3' ' NE2' ' A' ' 17' ' ' HIS . 23.3 m-20 -75.97 -58.74 3.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.979 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.581 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 15.8 t . . . . . 0 C--N 1.312 -1.05 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.662 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 11.9 tpt . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -47.77 -26.47 1.61 Allowed 'General case' 0 C--O 1.193 -1.9 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.7 m -59.41 -60.6 3.6 Favored 'General case' 0 C--O 1.272 2.251 0 CA-C-N 118.756 0.707 . . . . 0.0 111.503 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.606 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.4 pp -73.63 -25.9 21.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 122.246 1.022 . . . . 0.0 110.711 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 7.3 mm -68.72 -33.71 61.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -66.6 -42.77 86.36 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 m -59.78 -26.96 66.14 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.421 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.55 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 22.8 mm-40 -80.64 -62.71 1.59 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.98 -35.2 74.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -169.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.4 tpt . . . . . 0 C--O 1.241 0.65 0 C-N-CA 120.439 -0.504 . . . . 0.0 111.313 -175.113 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.443 0 N-CA-C 115.87 1.108 . . . . 0.0 115.87 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -72.75 -6.08 42.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -62.11 -18.25 60.21 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.28 0.562 . . . . 0.0 111.534 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -90.15 0.2 57.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.468 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.5 m-70 -113.05 4.39 16.65 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.541 0.686 . . . . 0.0 110.454 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HD12 ' A' ' 14' ' ' LEU . 7.7 p -129.15 125.68 62.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.1 m -96.54 154.05 17.5 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.093 -175.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 tm0? -53.77 -40.62 66.4 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 123.185 0.594 . . . . 0.0 111.105 177.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.42 -33.89 74.46 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.545 HD12 HG23 ' A' ' 10' ' ' VAL . 2.8 tm? -74.4 -51.05 16.13 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -175.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB2' ' OE2' ' A' ' 51' ' ' GLU . 8.1 ptm180 -63.21 -43.05 99.23 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.785 -1.098 . . . . 0.0 112.041 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.437 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 35.6 t -67.8 -26.15 65.93 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.65 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.659 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 20.6 t60 -71.95 -38.21 69.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.075 177.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -64.45 -35.57 81.36 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.251 175.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.1 t -56.06 -49.52 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-O 121.529 0.68 . . . . 0.0 109.654 175.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -57.37 -45.15 84.73 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.798 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' CD2' ' B' ' 115' ' ' LEU . 20.2 mttp -67.51 -35.55 79.33 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.351 177.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 19' ' ' VAL . 82.3 mt -56.74 -43.92 81.2 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.629 0.372 . . . . 0.0 110.037 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HA ' HG22 ' A' ' 26' ' ' ILE . 85.5 t -63.6 -48.38 87.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.321 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -63.49 -25.21 68.15 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.538 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.01 -46.27 16.91 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.292 176.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.487 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.5 tt -70.44 -35.78 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 109.997 -177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.44 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 53.5 t80 -121.82 99.28 44.6 Favored Pre-proline 0 N--CA 1.397 -3.078 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.512 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 43.1 Cg_endo -65.11 98.08 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.967 1.778 . . . . 0.0 108.603 171.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -71.2 132.9 85.85 Favored Pre-proline 0 N--CA 1.426 -1.673 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.321 -174.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -72.63 -37.15 4.25 Favored 'Trans proline' 0 C--O 1.217 -0.561 0 C-N-CA 122.524 2.149 . . . . 0.0 111.53 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -140.73 153.46 67.87 Favored Pre-proline 0 CA--C 1.494 -1.175 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.85 -15.54 49.57 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.338 2.025 . . . . 0.0 111.72 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.47 -18.94 54.14 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.314 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.92 -6.11 53.29 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.603 0.716 . . . . 0.0 110.019 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.8 mt -90.76 -0.48 57.72 Favored 'General case' 0 C--O 1.21 -1.018 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.342 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -132.74 20.6 4.21 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.202 1.001 . . . . 0.0 109.213 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.594 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 16.5 t70 -88.5 170.22 11.08 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.407 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.6 -25.45 68.1 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 122.997 0.519 . . . . 0.0 112.029 -179.341 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 38.8 ttp180 -75.14 -19.14 60.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 109.723 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.574 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 7.9 tpp -61.46 -46.56 89.52 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.792 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -58.85 -29.29 66.84 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 123.263 0.352 . . . . 0.0 110.922 -177.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.4 t30 -71.58 -51.74 21.82 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.68 0.752 . . . . 0.0 110.213 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.9 -45.75 84.59 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.103 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.0 p -73.26 -28.59 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.123 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.89 -49.74 76.63 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -56.51 -46.01 80.75 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.893 174.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.88 99.8 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 120.552 0.215 . . . . 0.0 111.187 -178.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.9 mttm -64.48 -48.1 76.47 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.134 0.574 . . . . 0.0 111.313 178.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.1 pttp -63.58 -40.63 97.44 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-O 121.282 0.563 . . . . 0.0 109.6 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.416 ' O ' ' HG2' ' A' ' 54' ' ' MET . 9.1 t -64.93 -47.86 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.619 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.9 tm-20 -54.16 -49.1 70.03 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 123.744 0.818 . . . . 0.0 109.766 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.22 -43.06 98.84 Favored Glycine 0 C--O 1.236 0.247 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.491 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.54 -52.42 65.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.97 0.508 . . . . 0.0 110.344 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.506 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 1.2 ptp -71.65 -27.92 63.4 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.572 0.952 . . . . 0.0 113.572 179.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -63.1 -49.48 74.29 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -78.38 -17.4 56.51 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.369 0.604 . . . . 0.0 111.864 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.506 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 24.7 m -79.97 -19.4 47.99 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.46 166.34 11.57 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -109.87 4.31 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.909 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -161.55 160.79 29.43 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.415 ' CD ' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -70.16 -36.15 74.49 Favored 'General case' 0 C--O 1.191 -2.017 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.584 -179.74 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.75 -31.59 70.74 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.55 -42.56 64.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.359 -0.213 . . . . 0.0 111.016 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -43.21 96.17 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -56.27 -48.95 75.55 Favored 'General case' 0 C--O 1.197 -1.668 0 C-N-CA 124.924 1.29 . . . . 0.0 108.857 173.74 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -59.37 -55.55 33.25 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 123.492 0.717 . . . . 0.0 111.09 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.462 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.8 pp -71.17 -29.89 65.76 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.314 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.455 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.66 -39.43 70.31 Favored 'General case' 0 C--N 1.344 0.329 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 176.799 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.547 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.28 -35.84 81.69 Favored 'General case' 0 C--O 1.202 -1.415 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.655 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.4 mm-40 -67.42 -42.87 82.51 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.075 0.55 . . . . 0.0 111.668 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -71.1 -36.55 72.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.654 -179.089 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.667 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -70.49 -38.78 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.506 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 19.2 t80 -52.81 -54.3 36.15 Favored 'General case' 0 C--O 1.265 1.883 0 C-N-CA 124.972 1.309 . . . . 0.0 110.997 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -65.26 -38.4 90.19 Favored 'General case' 0 C--O 1.189 -2.081 0 O-C-N 123.823 0.702 . . . . 0.0 110.117 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.15 -40.79 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.465 0.478 . . . . 0.0 110.712 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 60.5 mt-30 -61.98 -54.95 34.59 Favored 'General case' 0 CA--C 1.496 -1.115 0 O-C-N 123.87 0.731 . . . . 0.0 110.596 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -73.21 -27.12 61.44 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.815 -177.111 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.3 tt0 -67.9 -43.57 78.98 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HA ' ' HG3' ' A' ' 82' ' ' LYS . 4.3 pp -69.57 -33.66 73.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.291 178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 41.5 mt-10 -63.89 -52.91 57.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.184 176.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.84 -38.8 92.43 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.671 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.555 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.505 -0.779 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.239 178.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.403 HG23 HD22 ' B' ' 111' ' ' LEU . 8.7 t . . . . . 0 CA--C 1.546 0.815 0 CA-C-O 120.814 0.34 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 111' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 4.2 mm? -64.35 -50.59 67.14 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.955 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -69.94 -33.77 72.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.739 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -62.33 -46.84 86.88 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.789 -0.764 . . . . 0.0 110.424 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 66.4 tp -57.9 -41.8 83.37 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.778 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.545 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 50.6 mt -61.94 -66.14 0.58 Allowed 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.229 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.3 m -52.54 -36.01 54.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.457 0.703 . . . . 0.0 112.24 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 54.5 p -76.72 -55.31 5.61 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.975 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.86 -24.34 52.63 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -174.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.659 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 42.4 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -174.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.647 ' O ' HG12 ' B' ' 145' ' ' ILE . 16.0 tpt . . . . . 0 C--O 1.204 -1.313 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.43 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 7.1 tt0 -71.59 -25.99 62.41 Favored 'General case' 0 C--O 1.193 -1.88 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.678 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.5 m -55.47 -51.83 65.67 Favored 'General case' 0 C--O 1.266 1.971 0 CA-C-O 121.134 0.492 . . . . 0.0 110.329 175.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.531 HD11 ' SD ' ' B' ' 141' ' ' MET . 43.3 pt -67.0 -32.87 59.96 Favored 'Isoleucine or valine' 0 C--N 1.342 0.249 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.647 HG12 ' O ' ' B' ' 141' ' ' MET . 22.4 mm -65.68 -33.47 63.86 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.82 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.198 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.406 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 58.0 ttp180 -65.27 -43.02 92.58 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.129 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 49.3 m -62.41 -37.45 85.85 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.767 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.628 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 12.7 mm-40 -72.82 -43.85 62.18 Favored 'General case' 0 C--O 1.199 -1.575 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 178.375 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.406 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -68.13 -33.92 75.38 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.362 0.528 . . . . 0.0 110.673 -177.136 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 CA--C 1.496 -1.11 0 CA-C-O 121.046 0.45 . . . . 0.0 109.867 174.972 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.459 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 p-90 -70.48 -12.16 61.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -64.77 -19.47 65.83 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.049 0.452 . . . . 0.0 111.859 -177.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -90.23 -8.54 50.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.438 0.637 . . . . 0.0 110.117 179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -96.89 10.74 38.17 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.89 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.494 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.8 p -138.5 115.01 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.008 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.0 m -91.96 154.45 18.81 Favored 'General case' 0 C--N 1.289 -2.039 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -49.82 -41.62 45.29 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 123.527 0.731 . . . . 0.0 111.047 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.52 -41.15 72.73 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.143 0.577 . . . . 0.0 111.535 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.419 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -74.09 -50.47 19.4 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -173.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 19' ' ' VAL . 9.1 ptm180 -65.53 -38.41 89.57 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.026 -177.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -74.01 -22.67 59.5 Favored 'General case' 0 N--CA 1.423 -1.801 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.452 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 26.0 t60 -74.15 -35.26 64.05 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 174.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.629 HD23 HD21 ' A' ' 68' ' ' LEU . 3.1 mp -63.9 -38.27 90.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.3 t -60.89 -46.57 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.465 0.706 . . . . 0.0 109.421 172.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.452 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 23.5 t-80 -53.72 -48.48 69.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.438 176.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -65.21 -39.32 92.64 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.906 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 19' ' ' VAL . 49.9 mt -54.65 -48.05 72.79 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.216 0.322 . . . . 0.0 110.417 174.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.25 -48.99 85.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.018 0 O-C-N 123.842 0.714 . . . . 0.0 111.481 174.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -71.3 -20.58 62.18 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -176.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.499 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.36 -46.2 15.02 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.05 176.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.571 HD11 ' CG2' ' B' ' 145' ' ' ILE . 1.7 tt -70.47 -35.15 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-O 122.269 1.033 . . . . 0.0 108.724 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -127.87 89.14 51.42 Favored Pre-proline 0 N--CA 1.398 -3.035 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.946 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.41 84.16 0.37 Allowed 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.954 1.769 . . . . 0.0 107.663 171.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 t -52.14 134.58 40.34 Favored Pre-proline 0 N--CA 1.424 -1.735 0 CA-C-N 113.965 -1.47 . . . . 0.0 113.396 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.49 -22.35 21.42 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.203 2.602 . . . . 0.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -157.38 141.57 11.69 Favored Pre-proline 0 CA--C 1.511 -0.555 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -178.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -56.92 -18.09 26.49 Favored 'Trans proline' 0 CA--C 1.549 1.262 0 C-N-CA 122.921 2.414 . . . . 0.0 114.346 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.77 -15.17 57.98 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 121.493 -0.754 . . . . 0.0 112.06 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.39 -9.6 58.86 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.879 0.847 . . . . 0.0 109.463 176.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.8 mt -89.4 1.56 55.66 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 114.704 -1.134 . . . . 0.0 110.494 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -134.89 12.6 3.65 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.389 1.09 . . . . 0.0 109.497 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.599 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 31.7 t70 -87.36 177.65 7.06 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.985 -1.461 . . . . 0.0 110.001 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.599 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -18.08 62.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.435 0.636 . . . . 0.0 110.668 178.993 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -74.37 -28.02 60.92 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -64.48 -43.5 93.96 Favored 'General case' 0 C--O 1.193 -1.913 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.479 -176.394 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HA ' HG22 ' A' ' 44' ' ' VAL . 7.1 pt-20 -61.58 -29.6 70.13 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.088 0.47 . . . . 0.0 110.966 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -74.61 -44.2 51.82 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.698 176.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.74 -42.38 81.95 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.711 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.483 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 28.4 m -69.83 -35.77 66.54 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.124 0 CA-C-O 119.08 -0.486 . . . . 0.0 110.125 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.97 85.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.41 0.624 . . . . 0.0 109.691 176.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.524 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.69 -47.42 86.36 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.826 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.4 93.97 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.017 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 67.6 mttm -66.3 -44.33 83.77 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.292 0.637 . . . . 0.0 111.443 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.9 pttp -63.46 -41.11 98.62 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.599 0.714 . . . . 0.0 109.602 -179.048 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.414 HG11 ' HE2' ' A' ' 71' ' ' LYS . 38.0 t -66.29 -51.98 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.022 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.409 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.4 tm-20 -55.76 -47.79 76.4 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.271 1.029 . . . . 0.0 109.846 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.44 -38.62 96.06 Favored Glycine 0 N--CA 1.443 -0.857 0 O-C-N 123.665 0.603 . . . . 0.0 112.717 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -62.03 -51.95 65.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.452 0.644 . . . . 0.0 110.883 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.2 ptp -72.15 -27.29 62.5 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.929 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -62.54 -53.74 50.2 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.61 -26.45 65.37 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.863 -179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 t -78.87 -22.92 45.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -86.27 163.34 17.78 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.753 0.787 . . . . 0.0 112.847 -176.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -108.12 4.5 24.99 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.112 -178.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.422 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 9.8 p -167.32 154.9 8.97 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.693 0.797 . . . . 0.0 108.949 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.494 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.17 -31.8 66.26 Favored 'General case' 0 C--O 1.194 -1.866 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.616 -175.925 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.422 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 6.1 p-10 -72.23 -28.54 63.23 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.537 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 8.8 tp10 -73.63 -44.21 57.52 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -41.22 98.64 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-O 120.969 0.414 . . . . 0.0 109.94 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.47 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -55.85 -48.52 75.38 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 124.349 1.059 . . . . 0.0 108.293 171.954 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.3 t-80 -61.82 -57.91 10.0 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.732 1.213 . . . . 0.0 111.859 -175.402 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.601 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -66.41 -30.26 70.59 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.629 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -76.11 -34.22 59.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.438 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.606 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -65.11 -31.41 72.6 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 176.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 24.8 mm-40 -65.76 -50.14 65.82 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.954 0.883 . . . . 0.0 109.392 174.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -62.26 -45.24 94.16 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.101 -179.648 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.626 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -68.79 -34.84 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.677 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -176.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 34.0 t80 -55.63 -54.45 43.97 Favored 'General case' 0 C--O 1.271 2.223 0 C-N-CA 124.515 1.126 . . . . 0.0 110.471 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.3 ptpt -66.83 -32.45 73.73 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.83 -176.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.38 -41.67 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 O-C-N 123.152 0.283 . . . . 0.0 110.5 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 58.0 mt-30 -62.73 -51.54 66.76 Favored 'General case' 0 CA--C 1.478 -1.805 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.604 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.1 OUTLIER -70.89 -26.81 63.4 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.409 -178.853 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.17 -52.59 64.67 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -64.33 -39.46 93.94 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.968 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.53 -53.25 60.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 123.555 0.534 . . . . 0.0 111.345 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 77' ' ' LYS 0.266 13.1 pt-20 -76.69 -35.51 57.85 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -177.091 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 C-N-CA 118.976 -1.089 . . . . 0.0 111.8 -178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 110' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 17.6 m . . . . . 0 N--CA 1.442 -0.872 0 CA-C-O 121.304 0.573 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.29 -48.96 60.15 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.39 -178.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -66.08 -32.43 73.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.694 -177.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.78 -47.28 84.19 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.95 0.781 . . . . 0.0 109.379 175.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 110' ' ' THR . 94.8 mt -56.33 -41.56 76.27 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.778 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.83 -64.9 0.69 Allowed 'General case' 0 C--N 1.347 0.465 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.157 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.47 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 8.9 t -62.48 -33.42 74.81 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -174.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 27.2 p -70.77 -50.89 31.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -76.05 -46.49 28.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 119.136 -1.026 . . . . 0.0 112.308 -177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 9.7 m . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -172.598 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 10.4 ttm . . . . . 0 C--O 1.257 1.471 0 CA-C-O 121.416 0.627 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.574 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 32.8 mt-10 -48.89 -27.5 3.12 Favored 'General case' 0 C--O 1.191 -1.992 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -178.026 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 1.6 m -57.62 -59.61 4.93 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 119.415 1.007 . . . . 0.0 109.881 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 144' ' ' ILE . . . . . 0.413 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.7 pp -71.06 -24.24 24.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.748 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.574 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 9.4 mm -72.0 -45.65 62.82 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.389 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.755 175.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.479 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 96.8 mtt180 -63.69 -35.9 82.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 117.833 0.288 . . . . 0.0 110.902 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.1 m -62.12 -50.66 71.02 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.874 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.73 -40.7 98.03 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.474 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -75.67 -22.75 56.44 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.64 -0.663 . . . . 0.0 112.492 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 41.3 tpp . . . . . 0 C--N 1.34 0.17 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 173.236 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.914 0 N-CA-C 116.964 1.545 . . . . 0.0 116.964 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 p-90 -62.59 -16.87 58.56 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -12.59 54.24 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.987 0.423 . . . . 0.0 112.072 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.78 -26.01 34.81 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 109.818 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -90.87 2.75 55.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.687 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.462 HG23 HD12 ' A' ' 14' ' ' LEU . 7.6 p -135.6 110.52 11.42 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-O 121.535 0.683 . . . . 0.0 109.501 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.43 171.12 8.9 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.991 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -53.47 -43.57 68.26 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 124.298 0.999 . . . . 0.0 110.807 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -52.53 -44.23 65.62 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.599 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -75.72 -47.54 25.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -172.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' HG23 ' A' ' 19' ' ' VAL . 10.0 ptm180 -65.68 -44.72 85.36 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.486 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -68.93 -23.12 64.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 121.261 0.553 . . . . 0.0 109.545 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.669 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 34.3 t60 -68.38 -44.75 74.48 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 174.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.599 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.7 OUTLIER -63.12 -37.66 88.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 119.217 -0.993 . . . . 0.0 109.725 176.613 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.6 t -54.27 -46.74 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.586 0.554 . . . . 0.0 109.781 175.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.522 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 53.9 t-80 -61.05 -41.59 96.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.048 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.49 ' HE2' ' OE1' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -73.26 -31.34 64.03 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.167 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 19' ' ' VAL . 88.0 mt -56.9 -42.51 80.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 173.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 24.0 t -59.36 -53.53 46.91 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.848 172.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.49 ' OE1' ' HE2' ' A' ' 21' ' ' LYS . 46.3 mt-30 -61.76 -26.34 68.02 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.65 -46.99 13.56 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.562 177.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.651 HD11 HG23 ' B' ' 145' ' ' ILE . 4.7 tt -71.86 -29.65 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 122.111 0.957 . . . . 0.0 109.943 -177.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -130.23 83.43 63.02 Favored Pre-proline 0 N--CA 1.4 -2.954 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.306 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.48 84.03 0.13 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.58 2.186 . . . . 0.0 107.959 170.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.0 t -58.35 142.62 81.41 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.401 -171.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.11 -30.93 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.345 2.03 . . . . 0.0 110.57 174.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -146.12 139.77 14.87 Favored Pre-proline 0 CA--C 1.506 -0.75 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 -175.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -54.46 -22.13 26.41 Favored 'Trans proline' 0 CA--C 1.563 1.935 0 C-N-CA 122.668 2.245 . . . . 0.0 114.168 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.68 -10.0 59.72 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 121.199 -0.938 . . . . 0.0 112.105 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -80.39 -7.94 59.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 109.694 176.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 40' ' ' MET . 35.6 mt -86.93 2.73 48.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.225 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -133.12 16.12 4.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.544 0.688 . . . . 0.0 109.467 178.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 40' ' ' MET . 24.3 t70 -81.48 176.98 9.23 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.037 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.532 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.67 -22.78 62.44 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.918 -0.488 . . . . 0.0 111.725 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -73.1 -22.03 60.64 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.624 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.2 tpp -61.3 -45.61 93.74 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.838 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -59.62 -30.72 68.9 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.766 -0.773 . . . . 0.0 111.155 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -72.34 -46.05 57.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.068 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.13 -42.11 76.46 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.478 -178.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.624 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.7 p -73.26 -30.84 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.573 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.68 91.97 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.544 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -59.67 -48.36 81.96 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.272 175.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.32 97.17 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 120.617 0.246 . . . . 0.0 110.964 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -65.11 -45.4 85.28 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.5 pttp -62.47 -40.98 98.41 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.419 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.0 t -65.07 -52.78 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.991 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.214 179.268 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 15.1 tm-20 -57.65 -48.28 79.93 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.906 0.883 . . . . 0.0 109.652 -178.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.62 -40.52 94.78 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.963 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.28 -54.28 47.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.401 0.619 . . . . 0.0 110.5 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.5 ptp -68.75 -30.05 68.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -66.84 -38.41 86.33 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.831 0.824 . . . . 0.0 108.936 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -82.48 -25.62 33.36 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.868 -1.145 . . . . 0.0 112.648 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -82.93 -26.65 31.22 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 120.907 0.384 . . . . 0.0 111.898 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.72 155.76 25.36 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -175.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -102.33 -0.29 32.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.097 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 p -156.9 159.3 38.01 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.11 -27.61 62.75 Favored 'General case' 0 C--O 1.17 -3.12 0 C-N-CA 118.288 -1.365 . . . . 0.0 109.504 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.85 -40.35 87.88 Favored 'General case' 0 C--O 1.209 -1.037 0 O-C-N 123.625 0.578 . . . . 0.0 109.501 178.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.8 -45.52 85.91 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.82 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -47.55 82.61 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.441 ' HD1' ' N ' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -51.2 -48.63 61.94 Favored 'General case' 0 C--O 1.21 -0.988 0 C-N-CA 125.892 1.677 . . . . 0.0 109.756 174.055 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 28.7 t-80 -74.15 -49.39 23.9 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.676 -169.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -67.73 -29.46 68.7 Favored 'General case' 0 C--O 1.249 1.065 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.502 -178.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -73.22 -40.03 65.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.171 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.55 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.1 -34.5 75.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 123.381 0.425 . . . . 0.0 109.93 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 7.4 mm-40 -63.68 -46.28 86.28 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.362 0.665 . . . . 0.0 111.005 175.097 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.32 -36.97 69.02 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.345 -0.942 . . . . 0.0 112.108 -178.163 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.604 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -67.03 -38.75 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.036 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.516 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.96 -54.51 37.94 Favored 'General case' 0 C--O 1.254 1.329 0 C-N-CA 124.824 1.25 . . . . 0.0 111.271 175.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -66.04 -33.84 76.72 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.461 -175.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.71 -44.31 96.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 123.439 0.462 . . . . 0.0 111.103 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.2 mt-30 -61.27 -50.75 71.74 Favored 'General case' 0 CA--C 1.49 -1.341 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -176.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.615 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -73.62 -29.17 62.2 Favored 'General case' 0 N--CA 1.395 -3.221 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.961 -177.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 28.4 tt0 -62.61 -52.62 62.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.843 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 3.9 pp -60.61 -45.45 93.96 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 123.818 0.699 . . . . 0.0 110.813 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.55 -53.72 54.83 Favored 'General case' 0 N--CA 1.401 -2.923 0 O-C-N 123.898 0.749 . . . . 0.0 111.29 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.1 pt-20 -71.92 -34.27 68.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 119.769 -0.772 . . . . 0.0 113.043 -176.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.477 ' HB2' ' NZ ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.65 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.482 179.136 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 47.4 m . . . . . 0 N--CA 1.44 -0.933 0 CA-C-O 121.017 0.436 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.49 -54.9 21.62 Favored 'General case' 0 C--O 1.247 0.957 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.949 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 112' ' ' GLN . . . . . 0.41 ' HB2' ' OH ' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -73.07 -25.14 60.8 Favored 'General case' 0 C--O 1.247 0.971 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.574 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -60.1 -51.27 70.34 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.88 -45.61 86.11 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.935 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.12 -61.51 2.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.471 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.5 m -60.21 -40.61 90.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.424 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 60.7 p -77.39 -35.12 54.64 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.039 -174.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.1 -49.86 32.87 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.624 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 119' ' ' SER . . . . . 0.669 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 37.9 t . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -177.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.843 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 15.3 ttt . . . . . 0 N--CA 1.443 -0.795 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.602 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.6 mt-10 -48.57 -27.99 3.14 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -178.326 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.0 p -56.93 -59.7 4.66 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 121.671 0.748 . . . . 0.0 111.485 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.19 -24.3 24.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.406 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.651 HG23 HD11 ' A' ' 26' ' ' ILE . 14.8 mm -63.43 -46.45 95.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.79 173.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -59.85 -42.61 94.03 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 123.994 0.809 . . . . 0.0 109.19 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.5 m -66.33 -34.07 77.14 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.762 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -47.33 22.99 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.482 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.1 pp -66.94 -25.25 66.26 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 50.5 tpp . . . . . 0 CA--C 1.514 -0.416 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 175.934 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.358 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.3 m -82.23 160.48 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.228 0 CA-C-O 121.183 0.516 . . . . 0.0 111.449 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -83.88 102.66 12.54 Favored 'General case' 0 N--CA 1.414 -2.256 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.946 -173.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -108.16 118.8 37.7 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -28.68 53.54 Favored Glycine 0 C--N 1.31 -0.887 0 N-CA-C 114.176 0.43 . . . . 0.0 114.176 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -67.18 -19.24 65.54 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -71.32 -10.21 59.38 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 119.765 -0.774 . . . . 0.0 113.017 -175.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -83.69 -7.12 59.55 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.762 0.791 . . . . 0.0 109.185 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -99.81 7.14 45.23 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.001 -177.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.8 p -139.54 114.67 7.96 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.526 0.679 . . . . 0.0 109.348 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.1 166.28 13.5 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -49.13 -41.61 36.69 Favored 'General case' 0 C--O 1.206 -1.224 0 C-N-CA 124.351 1.061 . . . . 0.0 111.154 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -52.06 -47.07 65.3 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.203 0.601 . . . . 0.0 111.925 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.414 HD13 HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.05 -45.83 59.32 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.3 ptm180 -70.07 -42.58 72.6 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.752 -177.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.9 t -67.89 -26.74 66.15 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.602 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 8.7 t60 -70.7 -43.35 69.18 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 176.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.657 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -65.36 -37.91 88.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.478 176.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -57.05 -45.43 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 173.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 12.2 t-80 -57.98 -44.97 87.41 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.58 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.1 mptp? -64.36 -38.17 90.09 Favored 'General case' 0 CA--C 1.506 -0.713 0 C-N-CA 119.977 -0.689 . . . . 0.0 112.635 177.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.4 mt -54.75 -44.92 74.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 123.381 0.426 . . . . 0.0 109.88 176.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.433 ' HA ' HG22 ' A' ' 26' ' ' ILE . 54.0 t -63.83 -48.4 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.812 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 35.4 mt-30 -60.25 -27.96 67.66 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 120.954 0.407 . . . . 0.0 111.906 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.583 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.21 -46.58 14.61 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.772 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.544 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.7 tt -71.35 -30.18 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.699 0.762 . . . . 0.0 110.12 -176.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 70.9 t80 -127.89 103.87 21.14 Favored Pre-proline 0 N--CA 1.409 -2.494 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.341 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.454 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 57.1 Cg_endo -67.57 76.5 0.54 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.848 2.365 . . . . 0.0 110.463 175.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 13.0 t -60.46 126.42 84.56 Favored Pre-proline 0 N--CA 1.423 -1.807 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.976 -175.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HA ' ' H ' ' B' ' 131' ' ' GLY . 45.0 Cg_endo -73.18 -29.91 11.1 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.341 2.027 . . . . 0.0 111.574 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -146.9 143.87 19.12 Favored Pre-proline 0 C--N 1.308 -1.233 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.416 ' HA ' HD12 ' A' ' 35' ' ' LEU . 6.9 Cg_endo -53.74 -18.28 11.93 Favored 'Trans proline' 0 CA--C 1.557 1.634 0 C-N-CA 122.652 2.235 . . . . 0.0 114.05 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.56 -13.41 59.55 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.566 -0.709 . . . . 0.0 112.469 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.448 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -78.36 -6.53 55.43 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.452 1.12 . . . . 0.0 108.747 175.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.462 ' HA ' ' HE2' ' A' ' 40' ' ' MET . 21.8 mt -89.97 7.75 35.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.383 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.72 18.55 4.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.817 0.818 . . . . 0.0 109.323 173.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.598 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 20.5 t70 -80.79 173.78 12.27 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.477 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.598 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -65.5 -24.98 67.27 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 121.955 -0.465 . . . . 0.0 110.901 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 33.1 ttm180 -74.9 -22.35 58.68 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.739 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.0 tpp -59.4 -45.22 92.1 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.732 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -56.3 -36.09 68.27 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.199 0.524 . . . . 0.0 109.866 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -76.15 -43.87 40.86 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.377 1.071 . . . . 0.0 111.372 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 78.6 mt -70.04 -40.86 74.87 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.696 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.739 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.32 -30.7 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.896 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -61.21 -49.17 78.21 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 174.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.61 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 6.8 t80 -57.96 -44.44 87.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.674 0.79 . . . . 0.0 110.215 174.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.64 87.87 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.636 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -68.82 -40.3 79.57 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 1.4 ptmt -65.44 -41.74 93.16 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.359 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.7 t -65.5 -52.7 48.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.629 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -57.78 -51.28 70.21 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.648 0.779 . . . . 0.0 110.015 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -39.18 93.33 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 123.495 0.497 . . . . 0.0 112.941 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.96 -51.63 68.46 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.442 0.639 . . . . 0.0 110.91 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 2.3 ptp -73.59 -27.59 61.38 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.321 -0.854 . . . . 0.0 113.272 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -62.03 -47.39 84.94 Favored 'General case' 0 C--O 1.2 -1.503 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -74.04 -22.62 59.49 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 t -77.54 -32.26 53.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.96 169.46 11.52 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -120.29 17.61 12.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.911 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.7 p -167.88 151.11 5.92 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.55 -33.34 73.91 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.185 -177.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -65.65 -36.96 85.19 Favored 'General case' 0 C--O 1.198 -1.615 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.285 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 9.4 tp10 -67.84 -46.45 71.76 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.63 99.25 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.762 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -48.72 78.9 Favored 'General case' 0 C--O 1.206 -1.22 0 C-N-CA 123.766 0.826 . . . . 0.0 109.054 172.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.417 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 39.5 m-70 -61.23 -55.91 26.62 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.6 pp -64.9 -29.65 70.6 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 18' ' ' LEU . 0.3 OUTLIER -76.04 -39.19 56.09 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.522 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.8 -29.12 69.94 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 123.02 0.528 . . . . 0.0 109.642 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.466 ' HG3' ' H ' ' B' ' 102' ' ' SER . 72.7 mm-40 -67.81 -53.04 30.11 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.291 0.637 . . . . 0.0 111.656 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.42 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -66.16 -35.65 81.03 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 119.338 -0.945 . . . . 0.0 111.46 -177.732 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.567 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.99 -40.24 80.69 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.8 t80 -52.29 -54.56 29.85 Favored 'General case' 0 C--O 1.257 1.489 0 C-N-CA 125.047 1.339 . . . . 0.0 111.416 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 74' ' ' LYS . 16.1 ptpt -67.86 -35.46 78.59 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.017 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -62.39 -39.69 85.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 O-C-N 123.424 0.453 . . . . 0.0 110.83 177.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.583 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 46.6 mt-30 -64.36 -55.62 19.88 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 123.518 0.511 . . . . 0.0 110.822 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.3 ptpt -68.0 -28.66 67.61 Favored 'General case' 0 N--CA 1.417 -2.084 0 C-N-CA 119.632 -0.827 . . . . 0.0 112.459 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 82' ' ' LYS . 13.5 tp10 -58.57 -53.16 61.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 123.639 0.587 . . . . 0.0 109.833 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -67.34 -38.94 85.65 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 123.199 0.312 . . . . 0.0 111.708 -177.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -62.73 -53.16 58.6 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.541 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.7 pt-20 -72.06 -34.32 68.65 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 120.174 -0.61 . . . . 0.0 112.307 -176.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.603 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -64.17 -49.59 71.46 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 119.594 -0.843 . . . . 0.0 111.609 -178.305 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' B' ' 137' ' ' LEU . 0.6 OUTLIER -76.71 -28.65 55.93 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.124 -174.588 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -85.29 -57.53 3.04 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.7 p -123.61 -14.05 7.38 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 118.471 2.767 . . . . 0.0 118.471 -166.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.603 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 4.1 ptp180 -86.73 -26.75 24.06 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 117.591 -1.644 . . . . 0.0 110.605 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.9 mt . . . . . 0 C--O 1.251 1.161 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.664 177.311 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.715 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 102' ' ' SER . . . . . 0.466 ' H ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 m -124.85 -67.73 0.89 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . 0.328 25.6 ptt? 42.35 73.22 0.14 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.4 m -78.84 -34.25 45.31 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 105.08 -2.193 . . . . 0.0 105.08 171.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -103.98 117.42 34.27 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -78.29 -1.16 31.74 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLY . . . . . 0.622 ' HA2' HE22 ' B' ' 109' ' ' GLN . . . -88.81 65.53 3.26 Favored Glycine 0 N--CA 1.424 -2.117 0 C-N-CA 120.569 -0.824 . . . . 0.0 111.363 175.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.429 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 35.3 p-10 -115.67 -1.24 12.75 Favored 'General case' 0 C--N 1.296 -1.731 0 CA-C-N 115.164 -0.518 . . . . 0.0 110.764 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.622 HE22 ' HA2' ' B' ' 107' ' ' GLY . 0.0 OUTLIER -60.26 -34.97 74.48 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.066 -176.605 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 27.2 m -56.85 -50.03 73.67 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 122.884 0.474 . . . . 0.0 110.815 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -72.95 -39.97 65.77 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.314 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 84.9 mm-40 -63.49 -43.22 97.88 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.066 0.46 . . . . 0.0 111.076 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -66.89 -36.74 82.98 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 122.721 0.408 . . . . 0.0 110.77 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 61.6 tp -56.57 -53.85 52.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.43 -45.73 90.72 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.954 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.6 m -57.02 -36.14 70.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.985 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 38.5 m -77.27 -58.42 3.28 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.231 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.32 -60.12 4.36 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.611 ' O ' ' HA ' ' B' ' 123' ' ' SER . 6.0 m -74.0 -51.37 16.12 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.664 -171.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.91 -60.32 2.2 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -62.22 -56.41 18.91 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -79.57 -23.98 42.4 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.242 -0.286 . . . . 0.0 111.676 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.611 ' HA ' ' O ' ' B' ' 119' ' ' SER . 19.6 m 71.67 -59.15 0.56 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.792 1.237 . . . . 0.0 113.914 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -116.29 132.79 56.57 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.005 0.431 . . . . 0.0 111.008 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -175.89 65.59 0.1 OUTLIER Glycine 0 N--CA 1.421 -2.355 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -98.71 29.32 11.84 Favored Glycine 0 N--CA 1.443 -0.863 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -152.18 86.78 0.14 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 177.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' SER . . . . . 0.401 ' O ' HD11 ' A' ' 35' ' ' LEU . 28.2 t -142.4 145.59 33.98 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLY . . . . . 0.445 ' HA2' HG23 ' A' ' 29' ' ' THR . . . -154.66 160.09 29.38 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 178.78 43.32 0.07 OUTLIER Glycine 0 N--CA 1.44 -1.092 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.746 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLY . . . . . 0.448 ' H ' ' HA ' ' A' ' 30' ' ' PRO . . . -96.54 85.48 0.86 Allowed Glycine 0 C--N 1.301 -1.403 0 N-CA-C 110.359 -1.097 . . . . 0.0 110.359 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.8 p -68.75 115.56 8.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 121.327 0.585 . . . . 0.0 110.791 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 106.68 -9.76 41.12 Favored Glycine 0 N--CA 1.432 -1.595 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.117 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 119.87 178.86 16.44 Favored Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.064 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -142.62 75.46 0.32 Allowed Glycine 0 N--CA 1.431 -1.648 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.4 m -155.79 32.81 0.35 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.409 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.8 pp -94.15 -16.04 24.1 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.584 -173.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.613 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 3.2 mp0 -45.98 -56.87 4.94 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.038 1.335 . . . . 0.0 109.423 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 63.4 m 48.35 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.913 1.685 . . . . 0.0 114.608 175.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.31 -33.21 67.21 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.609 ' O ' HG12 ' B' ' 145' ' ' ILE . 14.3 tpt -58.77 -37.14 75.63 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.201 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 38.5 mt-10 -58.85 -27.28 64.99 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 24.8 t -61.57 -54.29 45.05 Favored 'General case' 0 C--O 1.249 1.066 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.543 HD11 ' SD ' ' B' ' 141' ' ' MET . 49.3 pt -66.01 -29.26 46.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.609 HG12 ' O ' ' B' ' 141' ' ' MET . 14.2 mm -64.16 -43.39 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.813 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 20.7 mtm180 -59.1 -42.51 90.65 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 48.3 m -59.94 -41.65 92.28 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.517 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 144' ' ' ILE . 28.9 mt-10 -77.2 -38.42 51.52 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.888 -0.508 . . . . 0.0 112.358 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.55 HD23 HG22 ' B' ' 145' ' ' ILE . 4.4 pp -75.36 -24.87 57.33 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 58.5 ttp -53.7 -58.5 6.99 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -101.55 155.76 17.89 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.756 0 O-C-N 123.416 0.447 . . . . 0.0 109.999 -178.101 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.487 -1.692 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 m -93.32 147.27 5.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 CA-C-O 120.712 0.292 . . . . 0.0 110.481 177.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.488 ' H ' ' HD2' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -109.48 125.89 52.94 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.706 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.483 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 11.7 ptpt -161.82 102.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.605 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -2.99 6.27 Favored Glycine 0 N--CA 1.461 0.307 0 N-CA-C 116.081 1.193 . . . . 0.0 116.081 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.483 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 69.1 p-90 -74.03 -7.09 51.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.06 0.93 . . . . 0.0 111.079 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -55.28 -25.03 31.4 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -87.26 0.24 55.68 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.431 0.634 . . . . 0.0 111.725 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -106.7 7.05 30.27 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.711 0.767 . . . . 0.0 109.907 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.99 110.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.698 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.442 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -91.05 160.03 15.81 Favored 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -176.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.97 -38.36 67.69 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.127 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.38 -39.16 85.62 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 120.901 0.381 . . . . 0.0 111.489 -177.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.08 -48.75 61.87 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -68.3 -38.99 82.17 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.738 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.9 t -65.15 -29.85 70.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.766 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 66.2 t60 -69.64 -42.63 74.02 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.46 176.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.593 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -60.88 -38.68 86.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.164 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 97.9 t -59.08 -51.04 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 121.296 0.569 . . . . 0.0 109.673 174.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -51.29 -47.88 62.44 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.576 1.15 . . . . 0.0 110.605 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.766 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 54.7 mttm -67.99 -37.86 81.98 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 86.9 mt -54.7 -42.88 72.01 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.69 -52.05 65.42 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.938 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.336 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -74.1 -14.51 60.99 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.711 -0.796 . . . . 0.0 112.936 -175.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.27 -46.27 15.02 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.757 173.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 5.0 tt -72.72 -28.93 28.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.618 0.723 . . . . 0.0 109.866 -177.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -132.59 92.57 26.95 Favored Pre-proline 0 N--CA 1.401 -2.894 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.216 -175.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.74 91.93 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.423 2.082 . . . . 0.0 107.928 170.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.5 123.23 78.12 Favored Pre-proline 0 N--CA 1.422 -1.872 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.893 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.03 -23.44 12.16 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.115 2.543 . . . . 0.0 111.683 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -143.87 143.04 21.62 Favored Pre-proline 0 CA--C 1.491 -1.302 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.28 -13.64 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 121.496 1.464 . . . . 0.0 110.697 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.32 -14.18 55.76 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.754 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.83 -12.14 60.31 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 122.047 0.927 . . . . 0.0 109.325 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 26.1 mt -83.98 0.61 47.32 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.464 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -133.18 19.01 4.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.91 0.862 . . . . 0.0 109.572 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.493 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.9 t70 -77.37 174.68 10.53 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.692 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.482 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -69.79 -27.41 64.88 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.327 0.585 . . . . 0.0 109.61 176.759 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 14.7 ttm180 -73.48 -21.3 60.46 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.297 0.57 . . . . 0.0 110.053 177.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.532 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -61.28 -40.34 93.74 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.491 177.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.0 pt-20 -62.56 -30.76 71.54 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 118.62 -1.232 . . . . 0.0 109.896 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -70.69 -48.5 54.39 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.71 1.204 . . . . 0.0 110.527 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.7 mt -67.92 -44.78 76.08 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.833 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.532 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.5 p -72.18 -32.34 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.414 -0.515 . . . . 0.0 109.93 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.62 -41.51 99.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.498 0.666 . . . . 0.0 109.319 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -60.56 -50.31 74.03 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.618 173.156 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.84 -40.57 88.96 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.989 0.423 . . . . 0.0 110.964 -177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.8 mttt -65.03 -48.27 74.46 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.301 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 15.0 pttp -63.8 -38.46 91.19 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 46' ' ' TYR . 55.2 t -64.43 -53.3 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.204 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -56.05 -46.81 78.79 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 124.09 0.869 . . . . 0.0 109.696 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.15 99.72 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.646 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -58.07 -53.27 60.1 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 123.292 0.637 . . . . 0.0 110.828 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.3 -32.92 74.22 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 178.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -64.66 -41.99 95.72 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 123.328 0.651 . . . . 0.0 109.56 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.43 -22.09 41.53 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.011 -0.431 . . . . 0.0 111.995 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.1 t -79.14 -54.18 6.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 160.08 14.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -171.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -102.59 -2.1 29.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.588 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.3 m -154.82 160.23 41.11 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.26 -36.9 69.15 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 118.799 -1.16 . . . . 0.0 111.753 -179.705 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.46 -38.14 83.22 Favored 'General case' 0 C--O 1.197 -1.66 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -47.09 77.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.299 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.09 91.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.53 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.1 OUTLIER -55.98 -48.67 75.41 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 125.66 1.584 . . . . 0.0 109.12 175.167 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -61.25 -55.56 30.54 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 123.842 0.857 . . . . 0.0 111.851 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.56 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.9 pp -68.61 -29.3 67.79 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 120.469 -0.493 . . . . 0.0 111.336 -175.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.593 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.76 -40.94 69.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.516 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.13 -38.07 78.77 Favored 'General case' 0 C--O 1.203 -1.363 0 C-N-CA 123.463 0.705 . . . . 0.0 109.699 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 4.8 mm-40 -60.94 -50.08 74.87 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.188 0.995 . . . . 0.0 111.825 175.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.429 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.77 -35.95 67.55 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 119.222 -0.991 . . . . 0.0 111.642 -177.515 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.65 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -67.93 -36.96 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.7 -54.23 40.87 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 124.976 1.311 . . . . 0.0 110.985 175.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -32.29 72.01 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.195 -176.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -64.06 -43.8 97.61 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 59.8 mt-30 -63.17 -51.62 65.67 Favored 'General case' 0 CA--C 1.493 -1.241 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.903 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.1 ptpt -72.16 -27.61 62.7 Favored 'General case' 0 N--CA 1.402 -2.852 0 C-N-CA 119.048 -1.061 . . . . 0.0 112.911 -177.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -60.72 -52.87 63.26 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.1 pp -65.38 -35.67 81.67 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.97 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.75 -44.54 73.53 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -71.19 -34.77 71.21 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 121.973 -0.454 . . . . 0.0 111.479 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HB2' ' NZ ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -74.38 -32.62 62.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.354 178.275 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.562 ' HG2' ' HG ' ' B' ' 137' ' ' LEU . 29.4 tpt180 -70.3 -40.14 74.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -62.18 -35.58 79.28 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 174.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 62.0 m 77.72 73.45 0.06 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.442 177.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -101.8 -10.56 19.81 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.14 176.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 C--N 1.304 -1.384 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.435 176.897 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.336 0 N-CA-C 111.34 -0.704 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.0 m -77.94 97.22 5.25 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.163 0.506 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 56.9 ttp -108.66 -67.07 1.0 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 11.8 p -102.91 154.61 19.04 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -105.75 145.26 31.37 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.454 ' HA ' HE22 ' B' ' 109' ' ' GLN . 98.5 m-85 -124.71 133.53 53.16 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.66 -25.56 5.31 Favored Glycine 0 C--N 1.302 -1.347 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 20.0 p-10 -87.42 -19.31 28.24 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 113.956 -1.122 . . . . 0.0 113.93 -174.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.503 ' CD ' ' H ' ' B' ' 109' ' ' GLN 0.381 0.0 OUTLIER -76.86 -11.73 59.86 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -178.059 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.3 m -69.85 -41.58 74.68 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.36 -40.13 74.21 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.845 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 75.9 mt-30 -61.87 -36.87 82.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.742 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -61.84 -46.88 87.57 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.734 0.646 . . . . 0.0 109.731 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.71 -47.2 74.01 Favored 'General case' 0 C--O 1.249 1.042 0 O-C-N 123.751 0.657 . . . . 0.0 110.081 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.497 HD23 ' CD ' ' A' ' 21' ' ' LYS . 85.8 mt -52.87 -62.05 1.9 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.532 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.53 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 7.3 t -69.08 -25.79 64.61 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.627 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -71.39 -52.12 20.32 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.406 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.536 ' HB2' ' NE2' ' A' ' 17' ' ' HIS . 54.1 m-20 -75.72 -31.97 59.86 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.676 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 47.0 p -71.22 -54.79 9.72 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.058 -0.657 . . . . 0.0 111.894 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.0 mt -80.9 -52.63 7.25 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 15.3 m -74.73 -48.31 26.44 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -82.8 -3.18 56.36 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.888 -0.507 . . . . 0.0 111.849 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 67.7 p 53.44 42.99 31.92 Favored 'General case' 0 C--O 1.245 0.844 0 C-N-CA 124.812 1.245 . . . . 0.0 111.811 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 10.4 t70 68.13 -79.41 0.04 OUTLIER 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.459 1.104 . . . . 0.0 112.406 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 82.04 -53.25 4.73 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 112.076 -0.41 . . . . 0.0 112.076 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 73.76 19.2 79.72 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -110.29 23.66 20.11 Favored Glycine 0 N--CA 1.437 -1.253 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 40.7 m -85.05 109.11 17.99 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -122.3 10.48 9.31 Favored Glycine 0 CA--C 1.5 -0.868 0 C-N-CA 119.783 -1.199 . . . . 0.0 111.995 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -79.79 123.35 6.07 Favored Glycine 0 N--CA 1.431 -1.643 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 176.58 150.51 8.27 Favored Glycine 0 N--CA 1.422 -2.244 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.9 p -161.97 -60.17 0.05 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 76.29 -68.8 2.33 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.705 -0.68 . . . . 0.0 113.674 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 166.72 59.73 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 110.684 -0.966 . . . . 0.0 110.684 -177.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 84.53 -84.11 1.6 Allowed Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.2 p -155.25 131.69 10.41 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.562 ' HG ' ' HG2' ' A' ' 83' ' ' ARG . 5.5 mp -106.04 -25.2 12.16 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -169.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.501 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 1.3 mp0 -59.03 -61.41 2.66 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 123.852 0.72 . . . . 0.0 110.808 -174.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t 45.61 -101.34 0.05 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.544 1.138 . . . . 0.0 113.736 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -74.99 -20.1 59.8 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 123.827 0.851 . . . . 0.0 110.035 -176.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.5 ttt -71.22 -26.24 62.84 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.638 -177.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.7 mt-10 -57.1 -27.9 62.18 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.2 m -67.39 -46.77 72.3 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 120.791 0.329 . . . . 0.0 110.417 178.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.446 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.8 pp -73.16 -27.73 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.726 0.774 . . . . 0.0 109.853 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 8.9 mm -66.77 -44.44 89.3 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.854 174.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.562 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 23.7 ttt180 -64.66 -37.32 87.16 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.367 0.417 . . . . 0.0 110.121 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 11.4 t -63.61 -43.68 96.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.75 -51.36 65.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.179 0.591 . . . . 0.0 111.65 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.576 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.4 pp -66.85 -24.52 66.15 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -176.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 24.3 ttt -59.86 -45.36 92.69 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.866 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -142.01 138.19 31.68 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.89 -173.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.053 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.528 178.985 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.644 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.0 m -80.59 133.68 28.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-O 121.35 0.595 . . . . 0.0 112.495 -178.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.475 ' H ' ' HD2' ' A' ' 3' ' ' ARG . 0.2 OUTLIER -99.88 75.65 1.9 Allowed 'General case' 0 N--CA 1.439 -1.007 0 CA-C-O 121.817 0.817 . . . . 0.0 110.935 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.547 ' HZ2' ' HA ' ' A' ' 56' ' ' GLU . 17.6 ptpt -94.4 94.53 8.31 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.274 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.07 0.2 8.22 Favored Glycine 0 C--O 1.218 -0.852 0 CA-C-N 115.079 -0.964 . . . . 0.0 115.291 -173.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.52 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 69.9 p-90 -77.49 -4.21 44.43 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 122.119 -0.636 . . . . 0.0 110.851 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -59.8 -18.09 40.94 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.267 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 11.4 pt-20 -90.32 -10.84 42.61 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.065 0.46 . . . . 0.0 111.059 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 64.6 m-70 -99.93 6.13 45.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.466 0.651 . . . . 0.0 110.575 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.455 HG23 HD12 ' A' ' 14' ' ' LEU . 6.1 p -127.76 110.64 22.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-N 114.913 -1.039 . . . . 0.0 108.304 177.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 m -74.94 150.16 39.16 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.121 -175.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 1.3 tm0? -58.59 -38.36 77.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.305 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 16.6 m-20 -67.29 -35.62 79.85 Favored 'General case' 0 C--O 1.197 -1.706 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.56 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.455 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -67.6 -50.04 60.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -63.23 -42.01 99.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.831 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.6 t -69.47 -30.35 68.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.666 0.746 . . . . 0.0 110.235 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.616 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 12.7 t60 -75.0 -35.44 62.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.378 -178.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 HD21 ' A' ' 68' ' ' LEU . 1.6 mp -65.63 -37.76 87.46 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 174.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.5 t -57.29 -46.02 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.6 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.0 t-80 -55.96 -47.96 76.69 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.824 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.616 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 3.4 mptp? -64.14 -37.66 88.25 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 178.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 26' ' ' ILE . 91.9 mt -53.53 -47.24 70.14 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.9 t -58.84 -50.85 77.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.218 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.2 mt-30 -60.46 -32.67 71.62 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.46 -43.34 19.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.526 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.55 -30.48 42.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 122.078 0.942 . . . . 0.0 109.552 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.576 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 75.9 t80 -127.95 86.26 58.6 Favored Pre-proline 0 N--CA 1.402 -2.873 0 CA-C-N 114.371 -1.286 . . . . 0.0 108.547 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.12 78.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.11 2.54 . . . . 0.0 109.678 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 t -59.28 136.94 88.62 Favored Pre-proline 0 N--CA 1.419 -2.0 0 CA-C-N 114.387 -1.278 . . . . 0.0 113.093 -173.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -75.66 -19.35 16.59 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.774 2.316 . . . . 0.0 111.513 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -160.89 142.61 9.06 Favored Pre-proline 0 CA--C 1.51 -0.594 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -53.41 -21.18 17.36 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 C-N-CA 122.884 2.389 . . . . 0.0 114.352 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.72 60.01 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 121.295 -0.878 . . . . 0.0 112.885 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.19 56.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.023 0.916 . . . . 0.0 109.209 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 40' ' ' MET . 19.4 mt -89.69 7.11 38.38 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.999 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -132.76 19.02 4.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.745 0.783 . . . . 0.0 109.373 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.604 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.8 t70 -82.84 175.51 10.03 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.295 -178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.62 -25.91 62.35 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.901 -0.499 . . . . 0.0 111.008 177.543 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.6 ttp180 -69.74 -21.44 63.46 Favored 'General case' 0 C--O 1.251 1.144 0 CA-C-O 121.79 0.805 . . . . 0.0 109.597 175.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.682 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.8 tpp -63.03 -41.36 99.51 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.345 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -59.57 -31.66 69.65 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.713 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.474 HD21 HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -75.38 -45.84 36.67 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.004 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.39 -42.53 92.56 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.334 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.682 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.1 p -73.4 -31.15 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.01 -48.4 81.85 Favored 'General case' 0 C--N 1.35 0.588 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -58.92 -46.65 87.43 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.322 175.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.23 94.52 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.07 0.231 . . . . 0.0 110.892 -178.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -62.45 -47.64 83.14 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 16.3 pttp -65.44 -35.58 81.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.109 0.48 . . . . 0.0 110.412 -177.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.772 ' O ' ' HG2' ' A' ' 54' ' ' MET . 42.8 t -70.71 -51.06 39.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.759 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -57.23 -45.51 83.83 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.352 0.661 . . . . 0.0 110.189 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.34 -38.27 96.16 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.874 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HB3' ' HE3' ' A' ' 54' ' ' MET . 21.4 t70 -58.13 -50.8 72.22 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.772 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.7 OUTLIER -65.98 -43.24 88.44 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.931 -175.11 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -56.59 -42.07 78.07 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.874 0.869 . . . . 0.0 108.774 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HA ' ' HZ2' ' A' ' 4' ' ' LYS . 12.5 mm-40 -83.2 -13.71 54.84 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.9 m -90.0 -24.76 21.15 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.642 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.99 164.48 11.79 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.586 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -125.22 19.08 8.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 m -158.78 153.85 25.25 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.437 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.56 -39.45 67.43 Favored 'General case' 0 C--O 1.191 -1.979 0 C-N-CA 118.954 -1.099 . . . . 0.0 111.532 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.96 -30.08 71.19 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -72.65 -49.8 29.36 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.811 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -42.48 98.56 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -57.75 -49.12 77.65 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 125.328 1.451 . . . . 0.0 109.781 174.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.3 t-80 -65.16 -50.86 64.33 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 123.223 0.327 . . . . 0.0 111.048 -173.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.6 pp -68.62 -30.99 69.83 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-O 120.991 0.424 . . . . 0.0 111.012 -176.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.7 pp -73.99 -35.54 64.45 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.79 -28.36 69.51 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.961 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 22.5 mm-40 -73.42 -42.58 61.88 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-O 120.994 0.426 . . . . 0.0 111.612 176.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.39 -37.45 74.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 118.626 -1.23 . . . . 0.0 110.632 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.6 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -68.77 -36.48 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.552 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 0.9 OUTLIER -51.4 -53.92 31.85 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.599 1.56 . . . . 0.0 110.801 173.508 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -67.08 -32.92 74.42 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.02 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.61 -42.98 97.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 123.045 0.215 . . . . 0.0 110.983 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.3 mt-30 -63.58 -52.25 61.78 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.567 0.699 . . . . 0.0 110.721 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 15.0 ptpt -71.05 -27.69 63.83 Favored 'General case' 0 N--CA 1.415 -2.179 0 C-N-CA 119.289 -0.964 . . . . 0.0 112.21 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.9 tp10 -59.98 -52.52 65.06 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -61.83 -42.13 98.65 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.791 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -59.26 -53.46 58.02 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.248 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -70.42 -37.04 74.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -69.96 -35.76 74.71 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.051 -175.765 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.43 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 11.3 tpt180 -77.04 -35.87 56.5 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.149 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -78.21 -60.11 2.5 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.676 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.5 m 170.58 87.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.758 1.623 . . . . 0.0 111.529 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -103.21 -23.83 13.6 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.199 -1.0 . . . . 0.0 109.176 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 C--O 1.25 1.125 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.795 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.954 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 48.2 m -75.38 114.24 13.7 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 115.18 -0.51 . . . . 0.0 111.148 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 20.0 mmt -95.04 159.96 14.78 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 11.6 m 63.84 24.75 13.84 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -173.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -83.18 108.01 16.13 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.906 -173.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -116.91 58.72 0.77 Allowed 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.309 174.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -90.62 52.64 3.36 Favored Glycine 0 CA--C 1.48 -2.122 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.154 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.454 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 37.4 p-10 -99.15 -1.75 38.6 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 113.813 -1.194 . . . . 0.0 110.39 -176.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER -53.4 -49.92 66.26 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -178.622 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 9.0 t -68.43 -27.14 65.93 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.78 -50.11 32.82 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.469 HE22 ' HB3' ' A' ' 69' ' ' ALA . 81.1 mm-40 -61.18 -44.37 97.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.609 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.22 -46.79 88.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.036 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.83 -41.7 78.31 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 20.8 mt -60.34 -62.16 2.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.433 176.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 11.1 t -63.76 -26.76 68.79 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -74.86 -56.29 4.92 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.856 0.36 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.1 -41.49 50.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.439 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 29.8 t -68.47 -54.62 15.79 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -173.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.56 -33.6 75.95 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 15.5 m -71.38 -38.64 71.5 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.726 0.298 . . . . 0.0 110.291 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -67.73 -39.36 84.29 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 44.2 t -69.31 -7.54 38.0 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-N 114.668 -1.151 . . . . 0.0 112.221 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -126.78 -54.23 1.42 Allowed 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.733 -175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -112.95 -150.3 10.77 Favored Glycine 0 N--CA 1.438 -1.228 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.88 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -91.29 5.65 80.98 Favored Glycine 0 N--CA 1.439 -1.156 0 C-N-CA 121.654 -0.308 . . . . 0.0 112.774 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -56.86 118.68 12.57 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 4.9 p -152.3 120.39 6.24 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -177.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -135.54 176.92 19.83 Favored Glycine 0 N--CA 1.419 -2.458 0 C-N-CA 119.828 -1.177 . . . . 0.0 112.549 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -141.29 174.36 22.9 Favored Glycine 0 N--CA 1.416 -2.643 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -171.72 -160.55 20.52 Favored Glycine 0 N--CA 1.427 -1.926 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.9 m 69.28 152.71 0.1 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.605 1.162 . . . . 0.0 112.892 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -175.57 58.98 0.11 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 176.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -91.86 -132.09 5.56 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.889 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 134.07 88.1 0.31 Allowed Glycine 0 N--CA 1.438 -1.194 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.7 m 79.37 6.41 2.03 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 124.947 1.299 . . . . 0.0 113.516 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.417 HD22 ' HG2' ' A' ' 83' ' ' ARG . 59.2 mt -76.88 -35.14 57.64 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 173.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.576 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 1.4 mp0 -58.33 -40.77 82.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.189 176.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 71.4 m -70.99 -12.52 61.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.742 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -80.48 -34.9 35.47 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 92.2 mmm -80.96 -30.61 35.11 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.665 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.555 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.285 43.7 mt-10 -47.16 -27.78 1.57 Allowed 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -173.422 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -73.82 -49.59 24.47 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 119.156 0.889 . . . . 0.0 110.897 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -73.4 -24.4 20.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-O 122.272 1.034 . . . . 0.0 110.079 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.555 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.7 mm -70.75 -35.51 60.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.539 172.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.45 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 38.7 ttt180 -59.08 -40.98 86.93 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.8 m -57.68 -53.34 59.27 Favored 'General case' 0 CA--C 1.553 1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.641 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -66.06 -38.64 88.85 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.474 HD22 HD21 ' A' ' 42' ' ' ASN . 4.1 pp -73.93 -31.45 63.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.436 ' N ' HD12 ' B' ' 149' ' ' LEU . 39.7 tpp -67.51 -34.94 78.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.8 t70 75.55 -50.55 0.64 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.621 1.568 . . . . 0.0 112.446 171.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.436 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.622 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.209 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.34 97.59 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.175 0 CA-C-O 123.14 1.447 . . . . 0.0 113.447 -176.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -120.01 31.31 6.58 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 113.291 -1.777 . . . . 0.0 107.049 177.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.652 ' HD3' ' CE2' ' A' ' 6' ' ' TRP . 16.0 ptpt -137.33 126.32 24.28 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 113.646 -1.615 . . . . 0.0 109.907 -171.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.6 -18.53 79.73 Favored Glycine 0 C--N 1.316 -0.572 0 N-CA-C 114.366 0.507 . . . . 0.0 114.366 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.652 ' CE2' ' HD3' ' A' ' 4' ' ' LYS . 69.2 p-90 -67.27 -6.07 16.81 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -61.64 -30.65 70.85 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 120.861 0.362 . . . . 0.0 111.067 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -71.85 -21.98 61.59 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.376 0.608 . . . . 0.0 111.318 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -87.43 -33.03 19.21 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.888 -176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.532 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.6 p -87.54 110.5 20.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.993 0.901 . . . . 0.0 109.788 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -71.53 149.54 45.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.908 -176.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.84 -37.58 82.57 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -56.79 -42.64 79.84 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.287 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.32 -52.03 21.02 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.763 0.792 . . . . 0.0 109.167 -173.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.8 ptm180 -64.48 -38.5 91.24 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.239 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 t -73.9 -23.98 59.64 Favored 'General case' 0 N--CA 1.424 -1.765 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -70.94 -37.5 72.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -64.84 -40.22 94.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.394 174.359 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 83.9 t -58.84 -45.97 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.364 0.666 . . . . 0.0 109.652 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -55.47 -47.29 76.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.173 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.649 ' HD3' HD23 ' B' ' 115' ' ' LEU . 35.7 mttp -66.21 -36.87 84.17 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.312 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 19' ' ' VAL . 60.4 mt -56.41 -45.39 80.71 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 123.241 0.338 . . . . 0.0 110.188 174.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -48.87 83.98 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 O-C-N 123.772 0.67 . . . . 0.0 111.813 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -71.76 -23.58 61.62 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.502 -176.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.45 -41.34 21.98 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.406 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.551 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.52 -34.36 57.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.61 87.09 56.88 Favored Pre-proline 0 N--CA 1.41 -2.467 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.623 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -68.06 77.3 0.62 Allowed 'Trans proline' 0 C--O 1.262 1.685 0 C-N-CA 122.5 2.133 . . . . 0.0 108.61 168.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.4 t -54.88 143.95 49.29 Favored Pre-proline 0 N--CA 1.427 -1.621 0 CA-C-N 113.444 -1.707 . . . . 0.0 113.142 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.32 -36.31 28.18 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.264 1.976 . . . . 0.0 110.66 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -149.03 142.13 15.77 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -53.81 -21.12 19.27 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.256 2.637 . . . . 0.0 115.307 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.83 -11.06 59.66 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 121.035 -1.041 . . . . 0.0 112.468 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.44 -12.86 60.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.181 0.991 . . . . 0.0 108.758 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -84.2 7.23 19.72 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.463 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -132.98 20.41 4.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.766 0.793 . . . . 0.0 109.791 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 35.4 t70 -86.86 174.97 8.42 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.422 ' H ' ' HD2' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -65.82 -25.22 67.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.944 0.402 . . . . 0.0 110.375 175.366 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.502 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.9 ttm180 -65.56 -31.37 72.38 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 10.2 tpp -60.73 -39.27 88.01 Favored 'General case' 0 CA--C 1.496 -1.128 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.099 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -33.67 76.51 Favored 'General case' 0 C--O 1.199 -1.555 0 C-N-CA 117.381 -1.727 . . . . 0.0 110.048 -177.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -66.59 -46.29 76.43 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 124.039 0.837 . . . . 0.0 110.386 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 85.8 mt -65.72 -47.05 76.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.928 -177.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.6 p -73.27 -31.87 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.1 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.09 94.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -60.12 -47.41 86.01 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 124.208 1.003 . . . . 0.0 110.322 174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.15 -45.24 94.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.773 -0.194 . . . . 0.0 110.738 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HE2' HG22 ' A' ' 44' ' ' VAL . 62.6 mttm -62.85 -40.04 96.24 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.881 0.472 . . . . 0.0 111.474 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 48.4 pttt -73.55 -36.37 65.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.862 0.363 . . . . 0.0 110.979 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' A' ' 54' ' ' MET . 40.5 t -67.4 -45.92 84.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -54.98 -47.85 74.03 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.831 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.77 97.1 Favored Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.793 -0.64 . . . . 0.0 113.206 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.63 -54.32 48.41 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.762 0.315 . . . . 0.0 110.962 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.594 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 1.8 ptp -70.17 -30.88 68.13 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -60.99 -49.59 76.81 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.601 ' HA ' ' HZ2' ' A' ' 4' ' ' LYS . 6.1 mm-40 -73.3 -24.31 60.39 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.448 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 37.9 m -76.16 -34.46 59.37 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.852 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.5 164.72 14.69 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.138 0.494 . . . . 0.0 111.967 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.04 15.37 13.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.001 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.5 m -158.4 150.48 21.65 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.532 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.38 -34.34 67.87 Favored 'General case' 0 C--O 1.187 -2.19 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.319 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -69.39 -32.24 71.12 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.874 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.502 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 11.9 tp10 -66.56 -51.68 53.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -39.25 92.23 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.784 -177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.683 ' CE1' HD13 ' B' ' 115' ' ' LEU . 11.9 t80 -61.46 -47.13 87.09 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.145 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.601 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 55.8 m80 -70.68 -43.54 68.84 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.594 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.6 pp -68.53 -31.09 70.07 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 120.379 -0.528 . . . . 0.0 112.186 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.7 OUTLIER -74.48 -39.27 62.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.538 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -54.22 -40.82 68.0 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.681 173.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 45.7 mm-40 -60.16 -48.56 81.23 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.511 0.672 . . . . 0.0 110.577 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 1.6 tptt -62.09 -48.31 80.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.322 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.591 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -34.34 67.35 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.186 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.466 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 5.4 t80 -55.5 -53.52 55.34 Favored 'General case' 0 C--O 1.257 1.477 0 C-N-CA 125.348 1.459 . . . . 0.0 110.943 174.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.7 ptpt -64.35 -34.36 77.97 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.717 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.482 HD13 ' HD2' ' A' ' 71' ' ' LYS . 1.5 mp -63.75 -43.95 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 123.326 0.391 . . . . 0.0 110.49 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.8 mt-30 -64.59 -52.12 59.17 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.9 -176.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.583 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.0 ptpt -71.16 -29.05 64.72 Favored 'General case' 0 N--CA 1.419 -1.997 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.1 -177.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.642 ' O ' ' HG3' ' A' ' 82' ' ' LYS . 48.9 tp10 -63.22 -51.77 64.9 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -64.0 -39.72 94.76 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.548 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -68.52 -44.37 74.76 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.7 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -69.17 -45.15 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 119.869 -0.732 . . . . 0.0 112.199 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 78' ' ' GLU . 0.0 OUTLIER -73.57 -33.73 64.79 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -177.204 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.453 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 3.4 tmt_? -77.03 -41.25 43.32 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.125 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.453 ' O ' ' HB2' ' A' ' 85' ' ' SER . 59.4 ttt180 -66.32 -60.65 2.57 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.663 -178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 13.8 t 162.58 118.82 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 82' ' ' LYS . 29.6 ptt180 -139.93 -19.59 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.039 171.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 C--O 1.256 1.419 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.547 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.868 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.8 m -77.81 -51.17 10.93 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 23.7 mmt 57.64 77.68 0.27 Allowed 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.534 1.134 . . . . 0.0 111.235 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 13.1 t -110.23 -51.94 2.82 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.976 -0.69 . . . . 0.0 109.27 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -96.11 8.63 43.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.95 0.881 . . . . 0.0 109.955 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -135.98 131.11 34.64 Favored 'General case' 0 N--CA 1.414 -2.234 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 173.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.83 -21.23 18.88 Favored Glycine 0 C--N 1.296 -1.689 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -175.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -81.27 -19.56 42.76 Favored 'General case' 0 C--N 1.281 -2.37 0 CA-C-N 113.747 -1.227 . . . . 0.0 112.414 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.496 ' HA ' ' OE1' ' B' ' 112' ' ' GLN . 4.8 pm0 -68.79 -32.59 72.43 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 41.1 m -59.12 -49.32 78.33 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.123 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.36 -53.12 48.17 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.481 -176.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.496 ' OE1' ' HA ' ' B' ' 109' ' ' GLN 0.366 0.0 OUTLIER -75.3 -27.61 59.4 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -176.552 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -73.68 -42.21 61.6 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.483 175.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.54 -45.78 90.79 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.683 HD13 ' CE1' ' A' ' 65' ' ' TYR . 9.0 mt -50.01 -61.77 1.96 Allowed 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.494 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -62.32 -42.29 99.25 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.623 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 41.9 m -63.94 -37.39 87.25 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.307 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -77.06 -53.1 8.21 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.4 m -62.31 -54.39 41.24 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -171.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 86.9 mt -74.14 -24.97 59.5 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.91 -0.716 . . . . 0.0 112.466 -174.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 17.7 m -75.87 -31.44 59.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -65.7 -50.73 63.8 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 46.0 m -59.63 -41.2 89.92 Favored 'General case' 0 C--O 1.239 0.512 0 O-C-N 123.663 0.602 . . . . 0.0 111.317 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.15 -43.94 98.09 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.443 0.639 . . . . 0.0 110.484 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 151.79 80.89 0.03 OUTLIER Glycine 0 N--CA 1.415 -2.703 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -151.62 163.83 30.09 Favored Glycine 0 N--CA 1.423 -2.172 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -115.59 45.55 1.28 Allowed Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.2 m -62.26 103.56 0.4 Allowed 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 123.617 0.767 . . . . 0.0 110.275 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 175.62 48.72 0.06 OUTLIER Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -137.39 94.65 0.22 Allowed Glycine 0 N--CA 1.428 -1.888 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -179.22 55.78 0.09 OUTLIER Glycine 0 C--N 1.3 -1.448 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -97.47 126.57 42.82 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 162.08 173.06 30.3 Favored Glycine 0 C--N 1.298 -1.568 0 C-N-CA 119.865 -1.16 . . . . 0.0 112.18 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 154.26 -43.87 0.59 Allowed Glycine 0 N--CA 1.432 -1.589 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 92.68 36.8 5.99 Favored Glycine 0 N--CA 1.439 -1.141 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.572 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 68.7 m 61.34 80.01 0.23 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 5.5 mp -102.56 -16.38 16.12 Favored 'General case' 0 C--O 1.245 0.855 0 CA-C-O 122.274 1.035 . . . . 0.0 108.467 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -64.88 -23.49 67.25 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.746 -1.57 . . . . 0.0 112.415 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 7.2 p -48.41 -30.33 4.92 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.747 1.219 . . . . 0.0 113.967 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -105.4 -14.04 15.45 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 121.837 0.827 . . . . 0.0 110.439 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.601 ' O ' HG12 ' B' ' 145' ' ' ILE . 7.7 tpt -81.0 -27.74 35.76 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.708 0.765 . . . . 0.0 109.117 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.535 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 50.4 mt-10 -52.57 -27.22 15.86 Favored 'General case' 0 C--O 1.199 -1.586 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.9 p -58.06 -59.96 4.47 Favored 'General case' 0 C--O 1.265 1.87 0 CA-C-O 122.083 0.944 . . . . 0.0 110.926 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.465 HD11 ' SD ' ' B' ' 141' ' ' MET . 41.8 pt -64.61 -29.93 48.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.61 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.601 HG12 ' O ' ' B' ' 141' ' ' MET . 17.7 mm -67.25 -40.56 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.007 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 99.1 mtt180 -59.58 -42.01 91.56 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.2 m -58.07 -47.36 83.41 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.903 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.82 -38.4 73.28 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -71.09 -31.19 67.5 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.752 -0.592 . . . . 0.0 110.369 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -76.81 -58.56 3.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.277 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -114.28 95.3 5.21 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.329 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.056 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 177.322 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.83 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.2 t -93.52 102.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.536 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.514 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -115.04 124.96 52.96 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.03 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 84.1 mttt -120.32 142.89 48.7 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.595 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.1 -28.0 57.98 Favored Glycine 0 N--CA 1.473 1.111 0 N-CA-C 114.93 0.732 . . . . 0.0 114.93 -172.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.419 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 69.4 p-90 -72.32 -9.62 58.73 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.71 -15.72 54.09 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 10.9 pt-20 -89.09 -9.3 51.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.288 0.566 . . . . 0.0 110.086 177.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -96.24 4.23 52.52 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.272 0.558 . . . . 0.0 109.77 -178.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.549 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.1 t -118.46 113.0 40.52 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.412 0 N-CA-C 104.716 -2.328 . . . . 0.0 104.716 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.0 m -65.98 149.93 49.46 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.463 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 21.2 tm0? -57.35 -39.98 77.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.334 0.588 . . . . 0.0 109.503 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.469 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.1 m-20 -63.96 -35.01 79.29 Favored 'General case' 0 C--O 1.196 -1.719 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.04 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.39 -51.44 15.02 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' O ' HG23 ' A' ' 19' ' ' VAL . 11.9 ptm180 -59.41 -42.74 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.106 0.479 . . . . 0.0 111.278 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 21.2 t -73.0 -24.84 60.8 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.36 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.592 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 10.3 t60 -74.94 -34.8 62.13 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.339 0.59 . . . . 0.0 109.749 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.494 HD23 HD21 ' A' ' 68' ' ' LEU . 2.0 mp -63.82 -39.14 93.53 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 173.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.8 t -59.05 -49.68 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-O 121.667 0.746 . . . . 0.0 109.464 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.461 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 28.5 t-80 -51.29 -49.46 61.24 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.925 1.29 . . . . 0.0 111.098 177.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 55.2 mttm -64.77 -36.87 85.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.395 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 91.8 mt -56.1 -47.51 77.92 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.389 0.431 . . . . 0.0 110.222 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.88 -49.15 84.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 O-C-N 123.769 0.668 . . . . 0.0 112.007 176.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -70.0 -23.21 63.11 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.449 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.2 -44.23 18.13 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.472 176.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.609 HD11 HG23 ' B' ' 145' ' ' ILE . 4.9 tt -70.73 -32.99 51.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.477 0.656 . . . . 0.0 110.149 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 1.2 m-85 -127.62 93.57 39.98 Favored Pre-proline 0 N--CA 1.416 -2.155 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.1 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.566 ' O ' ' HA3' ' B' ' 133' ' ' GLY . 28.3 Cg_endo -66.86 96.42 0.37 Allowed 'Trans proline' 0 N--CA 1.446 -1.32 0 C-N-CA 121.794 1.663 . . . . 0.0 108.141 170.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 11.0 t -74.35 139.17 75.01 Favored Pre-proline 0 N--CA 1.419 -1.978 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.992 -171.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 -28.62 5.83 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.241 2.627 . . . . 0.0 111.717 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -140.23 146.23 44.99 Favored Pre-proline 0 CA--C 1.483 -1.629 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 -177.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -67.26 -12.58 36.43 Favored 'Trans proline' 0 C--N 1.323 -0.774 0 C-N-CA 121.411 1.408 . . . . 0.0 110.787 174.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.15 57.65 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.745 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -77.84 -11.8 59.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.101 0.953 . . . . 0.0 108.654 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.542 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.8 mt -87.79 3.82 46.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.828 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -133.04 21.52 4.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.697 0.761 . . . . 0.0 109.532 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.562 ' O ' ' HB3' ' A' ' 40' ' ' MET . 17.4 t70 -89.08 172.24 9.25 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.716 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.538 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.23 -25.76 65.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.419 0.628 . . . . 0.0 110.928 -178.788 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 -76.74 -16.21 59.55 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.613 0.72 . . . . 0.0 109.56 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.562 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.5 tpp -65.5 -40.31 92.9 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.182 176.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.5 pt-20 -62.09 -27.88 69.22 Favored 'General case' 0 C--O 1.192 -1.921 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.055 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.48 -47.41 55.67 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.196 0.598 . . . . 0.0 110.565 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.25 -45.96 75.15 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.426 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -72.6 -30.74 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.141 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.43 94.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.6 t80 -56.92 -46.59 81.89 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.675 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.78 -47.8 81.91 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.441 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -62.59 -40.11 95.85 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.14 0.576 . . . . 0.0 112.362 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.8 pttp -72.51 -38.32 68.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.809 0.338 . . . . 0.0 110.681 -177.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.6 t -69.28 -47.08 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -58.71 -47.6 84.02 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.663 0.785 . . . . 0.0 109.34 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.51 -39.73 93.49 Favored Glycine 0 C--O 1.224 -0.507 0 O-C-N 123.644 0.59 . . . . 0.0 112.667 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -59.84 -54.75 42.56 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.946 0.403 . . . . 0.0 111.19 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.46 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -66.74 -32.54 73.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.382 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.29 -49.78 76.25 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 123.902 0.881 . . . . 0.0 109.706 173.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.43 -21.08 60.56 Favored 'General case' 0 C--N 1.31 -1.152 0 O-C-N 122.033 -0.417 . . . . 0.0 111.986 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -84.55 -39.46 18.76 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.63 169.76 15.91 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -174.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.35 6.49 16.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.685 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -164.34 151.57 11.71 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -63.46 -35.77 81.54 Favored 'General case' 0 C--O 1.178 -2.676 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.141 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.17 -36.15 82.66 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 123.923 0.764 . . . . 0.0 110.379 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -71.81 -46.66 57.43 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.826 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -40.42 95.81 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.523 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.433 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.3 OUTLIER -56.15 -49.91 72.65 Favored 'General case' 0 C--O 1.209 -1.045 0 C-N-CA 125.13 1.372 . . . . 0.0 109.369 174.499 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.439 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 35.9 t-80 -64.58 -54.16 36.39 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.419 -172.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.459 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.82 -29.97 69.26 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.447 -177.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.494 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -74.02 -38.26 64.11 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.725 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.7 -32.34 73.41 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 123.398 0.437 . . . . 0.0 109.838 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 12.1 mm-40 -70.85 -41.56 71.29 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 176.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -37.59 66.65 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 118.954 -1.098 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.7 tt -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.54 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.85 -54.12 38.92 Favored 'General case' 0 C--O 1.252 1.205 0 C-N-CA 125.004 1.321 . . . . 0.0 111.269 174.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -67.91 -34.81 77.35 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.911 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.97 -42.81 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 123.558 0.536 . . . . 0.0 110.476 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.4 mt-30 -61.82 -57.02 13.43 Favored 'General case' 0 CA--C 1.484 -1.567 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.081 -178.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.6 ptpt -66.23 -32.5 73.96 Favored 'General case' 0 N--CA 1.418 -2.057 0 C-N-CA 119.78 -0.768 . . . . 0.0 112.839 -176.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -59.45 -52.68 64.56 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -68.2 -41.7 80.96 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.964 -177.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.7 -43.34 99.05 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.6 pt-20 -75.5 -36.66 60.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.657 -177.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' B' ' 140' ' ' ASP . 0.0 OUTLIER -71.5 -28.37 63.87 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -77.0 -43.12 35.93 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.807 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -75.67 -61.03 2.06 Favored 'General case' 0 C--O 1.247 0.959 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.446 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p 168.96 90.37 0.0 OUTLIER 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.854 0.862 . . . . 0.0 111.652 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.451 ' HD2' ' HB3' ' A' ' 82' ' ' LYS . 8.1 ptm180 -108.83 -23.38 11.77 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--O 1.256 1.418 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.434 -179.621 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.705 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 4.7 p -86.51 120.17 27.55 Favored 'General case' 0 N--CA 1.426 -1.671 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.5 ptm -106.82 -6.36 17.76 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.12 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.6 m 54.23 64.66 1.75 Allowed 'General case' 0 C--O 1.243 0.745 0 O-C-N 124.126 0.891 . . . . 0.0 110.185 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -76.49 107.99 9.15 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.873 0.844 . . . . 0.0 112.177 -175.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -150.58 120.45 7.11 Favored 'General case' 0 N--CA 1.426 -1.635 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.858 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.46 -25.32 6.46 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -107.28 -10.58 15.77 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 -173.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -60.54 -37.57 81.63 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 123.517 0.51 . . . . 0.0 110.442 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 1.7 t -59.15 -48.44 81.6 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.005 177.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.42 -48.29 56.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -60.66 -43.76 97.26 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.291 0.369 . . . . 0.0 111.107 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.71 -38.58 80.35 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.176 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 110' ' ' THR . 81.7 mt -63.16 -38.89 92.97 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.294 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -56.7 -66.58 0.42 Allowed 'General case' 0 C--O 1.214 -0.808 0 O-C-N 123.362 0.414 . . . . 0.0 110.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.433 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 9.0 t -56.96 -46.94 81.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -173.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.1 t -72.21 -46.82 54.6 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.994 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -76.58 -36.34 57.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.542 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 72.6 p -62.66 -48.86 77.51 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.87 -15.28 59.75 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.478 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 17.0 t -76.86 -58.19 3.42 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.286 0.565 . . . . 0.0 109.745 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -76.35 -38.88 55.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.867 -178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 16.8 m 63.7 -84.59 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.023 1.329 . . . . 0.0 113.276 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.12 -39.1 85.09 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.235 0.614 . . . . 0.0 112.139 -176.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 177.44 -65.81 0.09 OUTLIER Glycine 0 CA--C 1.486 -1.739 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.93 -85.49 1.56 Allowed Glycine 0 N--CA 1.428 -1.896 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.628 177.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 163.24 -113.71 0.57 Allowed Glycine 0 N--CA 1.42 -2.41 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.356 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 38.3 m 67.33 27.88 8.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.551 1.14 . . . . 0.0 110.446 -176.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -132.76 41.41 1.49 Allowed Glycine 0 N--CA 1.436 -1.348 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.807 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.68 -24.17 77.15 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.667 -0.267 . . . . 0.0 112.882 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 145.16 107.03 0.53 Allowed Glycine 0 N--CA 1.433 -1.555 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.515 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 55.8 m -150.48 31.87 0.65 Allowed 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.593 0.711 . . . . 0.0 109.44 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' GLY . . . . . 0.566 ' HA3' ' O ' ' A' ' 28' ' ' PRO . . . -150.45 49.7 0.55 Allowed Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.126 -1.189 . . . . 0.0 110.126 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -80.25 74.31 2.35 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 -178.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 155.41 -174.68 33.49 Favored Glycine 0 N--CA 1.422 -2.282 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 7.3 p -89.93 96.29 10.61 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 117.661 0.73 . . . . 0.0 111.227 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.41 -51.26 3.05 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.263 1.03 . . . . 0.0 108.754 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -16.91 58.58 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.851 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 46.1 t -51.57 -46.26 63.38 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.338 0.655 . . . . 0.0 111.951 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ASP . . . . . 0.477 ' HB2' ' HE3' ' A' ' 82' ' ' LYS . 16.8 m-20 -82.1 -23.83 35.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.144 0.497 . . . . 0.0 111.103 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.624 ' SD ' HD11 ' B' ' 144' ' ' ILE . 13.9 tpt -76.38 -30.45 57.54 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.295 0.569 . . . . 0.0 109.617 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.599 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.4 mt-10 -49.66 -26.46 3.71 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.3 p -60.31 -59.47 5.36 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 121.362 0.601 . . . . 0.0 111.534 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.624 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.6 pp -70.78 -24.94 25.4 Favored 'Isoleucine or valine' 0 C--O 1.264 1.826 0 CA-C-O 122.28 1.038 . . . . 0.0 111.469 177.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.609 HG23 HD11 ' A' ' 26' ' ' ILE . 15.2 mm -65.1 -39.29 85.1 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.201 172.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -65.52 -40.7 93.27 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.885 177.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 5.2 p -60.75 -28.87 69.03 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.919 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -79.56 -52.23 8.27 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 119.13 -1.028 . . . . 0.0 112.198 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 2.4 pp -72.88 -23.12 60.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 17.0 tpt -76.17 -22.7 55.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 109.928 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -94.88 167.92 11.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.422 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.729 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.8 m -73.77 155.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.458 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -111.0 71.47 0.74 Allowed 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.595 1.188 . . . . 0.0 110.582 176.319 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.521 ' HD3' ' CZ2' ' A' ' 6' ' ' TRP . 16.1 ptpt -162.41 101.28 1.07 Allowed 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.692 -178.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -15.64 47.59 Favored Glycine 0 N--CA 1.468 0.782 0 N-CA-C 115.578 0.991 . . . . 0.0 115.578 -172.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.521 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 67.5 p-90 -67.46 -9.2 39.68 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -67.09 -17.73 65.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.188 0.518 . . . . 0.0 110.765 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.87 -10.0 59.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 121.243 0.544 . . . . 0.0 109.794 176.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -96.72 4.55 51.76 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.48 -178.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.467 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -138.09 110.66 6.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-O 122.068 0.937 . . . . 0.0 109.363 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -86.63 162.92 17.7 Favored 'General case' 0 N--CA 1.414 -2.245 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.788 -177.039 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -59.85 -36.85 77.71 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.754 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' B' ' 122' ' ' HIS . 2.6 p30 -57.25 -45.5 83.93 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' B' ' 119' ' ' SER . 3.3 tm? -69.61 -50.98 39.24 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.718 0.771 . . . . 0.0 108.945 -175.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.544 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.5 ptm180 -66.41 -41.35 89.4 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.064 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.404 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 14.5 t -70.79 -25.36 62.85 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 46.9 t60 -67.66 -40.55 84.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.517 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -65.32 -36.12 83.06 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.078 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -59.55 -44.73 93.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 123.521 0.728 . . . . 0.0 109.358 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.44 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.8 t-80 -58.77 -42.34 88.71 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.127 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.612 ' HD3' HD23 ' B' ' 115' ' ' LEU . 72.7 mttt -71.27 -36.32 71.68 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.1 mt -57.02 -44.09 82.49 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.9 t -58.01 -50.41 78.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 O-C-N 124.117 0.886 . . . . 0.0 111.827 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.65 -17.67 62.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.62 -46.33 13.42 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.452 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.654 HD11 HG23 ' B' ' 145' ' ' ILE . 4.4 tt -70.69 -36.79 66.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 122.05 0.929 . . . . 0.0 108.925 -177.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 5.5 m-85 -130.16 88.06 49.27 Favored Pre-proline 0 N--CA 1.397 -3.087 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.624 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -61.6 94.44 0.12 Allowed 'Trans proline' 0 N--CA 1.438 -1.74 0 C-N-CA 121.878 1.719 . . . . 0.0 108.489 173.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -68.72 136.75 90.26 Favored Pre-proline 0 N--CA 1.401 -2.923 0 CA-C-N 113.883 -1.508 . . . . 0.0 111.68 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.18 -32.52 4.06 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.511 2.141 . . . . 0.0 110.612 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -137.46 146.27 52.88 Favored Pre-proline 0 CA--C 1.482 -1.659 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.122 -174.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -68.5 -11.45 31.98 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.626 1.551 . . . . 0.0 111.446 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.88 -9.23 54.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.57 -13.41 59.92 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.3 mt -84.53 7.24 20.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 113.921 -1.49 . . . . 0.0 110.612 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.87 14.04 4.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.756 0.789 . . . . 0.0 109.613 176.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.6 t70 -81.16 171.04 15.38 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.526 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.435 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.18 -28.57 69.84 Favored 'General case' 0 C--N 1.31 -1.129 0 O-C-N 122.14 -0.35 . . . . 0.0 111.289 -179.157 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.481 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 19.7 ttm180 -70.3 -20.16 63.04 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.574 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.7 tpp -63.84 -42.87 97.5 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.444 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.48 -33.87 73.22 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.86 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -68.69 -48.21 64.48 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 84.7 mt -67.48 -42.08 83.53 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.032 -178.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.574 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.0 p -73.09 -33.55 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -62.07 -48.82 78.49 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 175.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.59 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 1.7 t80 -56.28 -42.89 78.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.099 0.96 . . . . 0.0 110.512 174.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -69.14 -38.46 78.83 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.986 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.3 mttm -64.36 -39.57 94.14 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 120.67 0.271 . . . . 0.0 111.364 177.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 4.3 ptmt -68.0 -44.14 77.25 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.477 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.2 t -62.32 -50.44 79.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -56.31 -50.06 72.53 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.371 1.068 . . . . 0.0 109.26 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.78 -32.78 80.35 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.137 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -70.07 -49.34 52.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.932 0.396 . . . . 0.0 110.732 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.427 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -65.8 -30.33 70.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 177.651 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.468 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 78.1 t80 -61.75 -42.35 98.85 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 3.4 mm-40 -82.03 -13.27 57.61 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 t -87.63 -27.14 22.67 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-O 121.105 0.479 . . . . 0.0 110.56 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -95.55 165.83 12.15 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -116.54 8.52 13.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.709 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.0 p -158.42 156.66 30.81 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -32.94 67.35 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.853 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.78 -37.63 88.27 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 178.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -64.96 -47.47 77.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.903 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -40.99 98.32 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.048 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.697 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 7.0 t80 -64.01 -42.98 96.98 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.161 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.505 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.4 m80 -62.77 -57.21 11.73 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.05 176.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.1 pp -64.23 -30.22 71.29 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -173.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.511 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -72.36 -46.51 55.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 175.606 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.512 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -53.86 -34.27 58.88 Favored 'General case' 0 C--O 1.207 -1.16 0 O-C-N 123.825 0.703 . . . . 0.0 110.809 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.707 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 14.1 mt-10 -74.09 -45.35 49.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -67.72 -37.69 82.58 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.944 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 2.4 tt -69.31 -35.67 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.707 ' CD2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -69.45 -38.54 77.82 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.286 -178.716 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -68.19 -33.29 74.16 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.386 0.428 . . . . 0.0 110.068 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.66 -41.45 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.066 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 49.7 mt-30 -65.37 -45.43 84.12 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 120.957 0.408 . . . . 0.0 110.617 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.5 ptpt -71.41 -26.98 62.99 Favored 'General case' 0 N--CA 1.424 -1.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.72 -47.02 73.66 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -66.38 -34.42 77.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.084 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -65.66 -53.32 42.96 Favored 'General case' 0 N--CA 1.407 -2.579 0 C-N-CA 124.007 0.923 . . . . 0.0 110.314 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -62.29 -38.18 88.38 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -71.51 -31.16 66.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.026 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 1.0 OUTLIER -77.12 -42.45 37.9 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.601 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 85' ' ' SER . 23.2 ttm180 -57.87 -60.26 3.98 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 124.248 0.968 . . . . 0.0 110.273 -175.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 29.4 t 153.78 91.7 0.0 OUTLIER 'General case' 0 C--N 1.36 1.029 0 C-N-CA 125.501 1.52 . . . . 0.0 109.354 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.501 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 40.1 ptt180 -109.55 -24.57 10.91 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.972 174.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 86' ' ' ARG . 3.8 mm? . . . . . 0 C--N 1.314 -0.957 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.608 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 25.0 m -154.04 159.27 41.49 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 95.8 mmm -115.88 94.44 4.67 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 5.1 p -88.91 15.88 7.81 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.192 -176.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -135.58 143.02 45.42 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -83.91 88.39 7.13 Favored 'General case' 0 CA--C 1.481 -1.689 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.43 84.16 0.01 OUTLIER Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 113.329 -1.76 . . . . 0.0 115.504 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -121.24 -17.74 7.59 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.762 0.792 . . . . 0.0 109.47 169.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.47 ' CD ' ' H ' ' B' ' 109' ' ' GLN . 18.8 mp0 -64.84 -49.47 70.44 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.562 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 30.2 m -55.62 -45.93 77.45 Favored 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 114.001 -1.454 . . . . 0.0 110.617 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.93 -51.98 16.4 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.535 -173.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -67.52 -36.73 81.6 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.517 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.69 -46.36 82.71 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.006 0.432 . . . . 0.0 110.112 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.83 -44.78 96.48 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.261 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.697 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 21.9 mt -55.09 -67.29 0.28 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.856 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 13.7 t -58.0 -28.91 64.85 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.8 p -73.97 -52.6 12.31 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.809 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.529 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 53.6 m-20 -76.21 -43.74 40.88 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 119.154 -1.018 . . . . 0.0 112.319 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.469 ' HB3' HD22 ' A' ' 14' ' ' LEU . 20.1 m -56.5 -54.02 50.66 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.547 0.689 . . . . 0.0 111.705 -173.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.54 -11.13 60.13 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.451 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 32.1 t -71.26 -24.73 62.22 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' HIS . . . . . 0.419 ' CE1' ' HA2' ' B' ' 127' ' ' GLY . 31.8 m-70 -73.43 -22.86 60.11 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.882 0.849 . . . . 0.0 109.667 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.2 t -91.82 12.23 22.16 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -127.15 -53.12 1.4 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.48 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 157.0 101.75 0.18 Allowed Glycine 0 N--CA 1.434 -1.446 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.77 178.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 141.08 142.01 4.07 Favored Glycine 0 N--CA 1.436 -1.341 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.351 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' GLY . . . . . 0.419 ' HA2' ' CE1' ' B' ' 122' ' ' HIS . . . -96.03 82.67 0.81 Allowed Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.7 m -63.63 111.94 2.6 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 123.673 0.789 . . . . 0.0 112.209 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -101.26 -123.92 5.28 Favored Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.17 159.69 10.6 Favored Glycine 0 C--N 1.305 -1.147 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -105.97 -179.17 23.52 Favored Glycine 0 C--N 1.307 -1.061 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -130.81 -49.2 1.04 Allowed 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.384 -0.927 . . . . 0.0 110.954 -176.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 115.95 92.35 1.76 Allowed Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -83.69 133.56 11.98 Favored Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -158.72 35.42 0.5 Allowed Glycine 0 N--CA 1.436 -1.365 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.0 m 59.11 67.38 0.92 Allowed 'General case' 0 C--O 1.245 0.818 0 CA-C-O 122.751 1.262 . . . . 0.0 112.482 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' B' ' 141' ' ' MET . 2.8 mm? -104.5 -26.63 12.31 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.543 175.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -90.35 -43.24 10.46 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -169.064 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 62.2 m -52.26 -38.43 58.19 Favored 'General case' 0 CA--C 1.558 1.261 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -173.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -96.14 -11.95 25.46 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 121.607 -0.683 . . . . 0.0 111.025 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.498 ' SD ' ' HE2' ' A' ' 82' ' ' LYS . 11.9 tpt -81.33 -22.43 38.48 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.603 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -50.89 -27.13 6.83 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.0 m -58.78 -53.53 57.38 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-O 121.053 0.454 . . . . 0.0 110.681 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . 0.25 2.7 pp -73.92 -24.17 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 121.164 0.506 . . . . 0.0 111.147 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.654 HG23 HD11 ' A' ' 26' ' ' ILE . 13.8 mm -65.17 -42.52 94.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.081 172.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.474 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 49.0 ttp180 -62.08 -37.67 85.91 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.674 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.2 m -56.55 -53.89 52.28 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 123.662 0.601 . . . . 0.0 110.224 172.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.2 -41.54 90.05 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG 0.268 3.4 pp -68.29 -31.23 70.53 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.57 -0.707 . . . . 0.0 111.764 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.5 ttt -77.05 -54.93 5.92 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.454 177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -105.24 120.74 42.29 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.101 0.477 . . . . 0.0 111.95 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.025 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.853 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.787 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.6 m -125.56 148.94 30.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.69 116.41 24.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 121.734 0.778 . . . . 0.0 112.02 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 12.3 ptpt -154.17 112.21 3.53 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.75 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.26 -8.17 22.89 Favored Glycine 0 N--CA 1.47 0.912 0 N-CA-C 116.424 1.33 . . . . 0.0 116.424 -170.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.403 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 70.4 p-90 -79.9 -3.0 46.18 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 121.543 -0.975 . . . . 0.0 110.027 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.545 ' HB2' ' O ' ' A' ' 4' ' ' LYS . 7.2 t60 -60.84 -32.34 71.74 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 125.936 1.695 . . . . 0.0 108.809 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -81.71 -4.26 55.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.147 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -109.23 -15.67 14.24 Favored 'General case' 0 CA--C 1.499 -1.002 0 CA-C-O 121.3 0.571 . . . . 0.0 111.627 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 7.5 p -101.98 109.8 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.179 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -81.22 150.5 28.58 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.256 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -56.21 -39.96 73.29 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 123.542 0.526 . . . . 0.0 110.146 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -64.07 -33.58 76.08 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.859 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.72 -48.08 34.64 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 8.3 ptm180 -69.8 -41.49 74.97 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.276 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.7 t -70.18 -23.09 62.91 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.484 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 18.8 t60 -71.07 -42.37 69.5 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 68' ' ' LEU . 1.9 mp -62.06 -38.25 88.07 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.463 176.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 93.8 t -60.31 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.19 0.596 . . . . 0.0 109.505 172.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -52.96 -46.61 68.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.699 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.484 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 61.5 mttm -65.66 -39.47 91.4 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.7 mt -55.31 -45.5 76.32 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.358 0.411 . . . . 0.0 110.142 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.9 t -60.49 -55.01 27.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 O-C-N 123.852 0.72 . . . . 0.0 111.187 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.04 -26.74 68.42 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -176.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.52 -45.84 15.35 Favored 'General case' 0 C--O 1.206 -1.228 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.576 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.541 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.2 tt -70.43 -28.35 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 121.952 0.882 . . . . 0.0 109.639 -177.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.1 86.5 51.22 Favored Pre-proline 0 N--CA 1.394 -3.25 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.445 -177.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.76 98.49 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.399 0 C-N-CA 122.244 1.963 . . . . 0.0 107.413 168.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 t -73.61 142.86 81.32 Favored Pre-proline 0 N--CA 1.408 -2.546 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.653 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.53 -24.74 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.385 2.056 . . . . 0.0 111.435 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -155.7 142.61 13.55 Favored Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -174.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.31 -24.68 61.25 Favored 'Trans proline' 0 C--N 1.321 -0.873 0 C-N-CA 122.73 2.287 . . . . 0.0 114.659 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.33 -8.11 58.83 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.248 -0.908 . . . . 0.0 111.936 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.2 -11.39 59.82 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.733 0.777 . . . . 0.0 109.185 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.7 mt -87.73 3.49 47.83 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.262 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.0 19.22 4.1 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 122.534 1.159 . . . . 0.0 109.169 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.0 t70 -83.34 177.77 8.35 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.092 -177.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.29 -33.26 71.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.123 0.487 . . . . 0.0 110.158 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -69.21 -20.33 63.98 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 122.112 0.958 . . . . 0.0 109.935 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.607 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -62.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.696 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 38' ' ' ARG . 0.2 OUTLIER -62.39 -32.77 73.64 Favored 'General case' 0 C--O 1.174 -2.895 0 C-N-CA 118.144 -1.422 . . . . 0.0 110.785 -178.396 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.21 -47.98 66.43 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.591 0.557 . . . . 0.0 110.872 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.6 -44.64 77.62 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.863 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.607 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.7 p -73.46 -32.72 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.027 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.45 94.58 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.629 0.728 . . . . 0.0 109.094 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.497 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -58.56 -47.09 85.38 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.496 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.01 98.17 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.801 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 94.1 mttt -63.24 -44.0 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.106 0.563 . . . . 0.0 111.315 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.5 pttp -68.46 -39.42 81.43 Favored 'General case' 0 C--O 1.25 1.095 0 CA-C-O 121.307 0.575 . . . . 0.0 110.605 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.42 -50.83 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.687 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -56.71 -48.51 77.55 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.142 0.977 . . . . 0.0 109.668 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.97 -40.24 93.01 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.38 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -61.52 -55.25 33.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-O 120.336 0.112 . . . . 0.0 110.879 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -64.75 -28.61 69.7 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.735 0.642 . . . . 0.0 112.735 179.743 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -64.53 -51.68 61.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -70.64 -24.42 62.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.62 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 64.9 m -82.29 -33.61 29.0 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.5 164.75 18.61 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.326 0.584 . . . . 0.0 112.422 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -113.15 13.6 19.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.402 0.62 . . . . 0.0 111.351 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.6 p -163.78 153.9 15.16 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 171.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -70.36 -33.67 71.72 Favored 'General case' 0 C--O 1.188 -2.177 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.312 -178.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.97 -35.82 82.41 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -67.07 -46.91 72.87 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.286 175.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.63 -44.82 95.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.773 0.671 . . . . 0.0 109.609 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -49.33 75.61 Favored 'General case' 0 C--O 1.208 -1.125 0 C-N-CA 125.077 1.351 . . . . 0.0 109.492 175.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -63.5 -49.61 72.87 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.62 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.5 pp -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.628 -176.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.06 -36.89 58.82 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 177.444 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.613 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -36.56 84.14 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.02 -47.29 83.71 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.633 0.73 . . . . 0.0 110.954 174.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -44.38 93.98 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.5 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.613 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.9 tt -69.58 -35.77 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.374 -177.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.549 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.46 -54.25 43.44 Favored 'General case' 0 C--O 1.26 1.625 0 C-N-CA 124.525 1.13 . . . . 0.0 110.936 175.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.15 -32.4 73.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.374 -176.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.24 -45.71 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.821 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.636 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 36.4 mt-30 -59.28 -53.83 53.75 Favored 'General case' 0 CA--C 1.481 -1.705 0 O-C-N 123.798 0.686 . . . . 0.0 111.364 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.648 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -67.7 -35.22 78.41 Favored 'General case' 0 N--CA 1.415 -2.21 0 C-N-CA 119.192 -1.003 . . . . 0.0 112.524 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 12.0 tp10 -59.98 -48.86 79.96 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.649 ' HB2' ' OE1' ' B' ' 138' ' ' GLU . 4.6 pp -67.11 -43.77 81.64 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.6 -49.85 69.49 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 123.28 0.362 . . . . 0.0 111.356 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -68.36 -31.74 71.33 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -72.92 -34.28 66.5 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.107 -0.637 . . . . 0.0 111.45 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HG2' HD22 ' B' ' 137' ' ' LEU . 12.2 tpt180 -76.27 -36.94 58.18 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 119.751 -0.78 . . . . 0.0 109.076 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -59.52 -43.44 93.43 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.6 t 76.77 85.41 0.08 Allowed 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.443 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -99.69 -11.36 20.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.271 176.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 C--O 1.245 0.825 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.469 -175.304 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.758 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.1 m -90.63 88.55 7.16 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-O 121.196 0.522 . . . . 0.0 111.59 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -88.07 72.13 9.22 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 170.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.7 t -80.05 94.7 6.0 Favored 'General case' 0 N--CA 1.403 -2.78 0 CA-C-N 112.848 -1.978 . . . . 0.0 111.909 -169.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -102.15 -8.4 21.4 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.228 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.448 ' HA ' ' HG2' ' B' ' 109' ' ' GLN . 72.1 t80 -148.98 151.81 35.22 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.04 -32.75 7.16 Favored Glycine 0 CA--C 1.499 -0.965 0 N-CA-C 110.28 -1.128 . . . . 0.0 110.28 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.604 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 40.9 p-10 -100.07 -0.41 39.13 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.277 -0.961 . . . . 0.0 109.844 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.448 ' HG2' ' HA ' ' B' ' 106' ' ' TYR . 32.3 mm-40 -63.62 -27.91 69.56 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.248 -174.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 5.3 t -66.25 -44.3 84.08 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.037 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.54 -42.82 67.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.973 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.604 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 7.3 mm100 -62.57 -35.31 79.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -66.52 -44.47 82.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.056 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 110' ' ' THR . 71.8 mt -60.5 -42.73 96.94 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.041 0.448 . . . . 0.0 109.795 177.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.435 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 3.1 mm? -53.63 -59.02 5.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.686 175.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 19.4 m -60.93 -44.14 97.64 Favored 'General case' 0 C--O 1.247 0.929 0 O-C-N 123.858 0.724 . . . . 0.0 111.347 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' B' ' 121' ' ' SER . 44.7 m -62.9 -46.66 86.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.537 -174.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.432 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 17.2 m-20 -76.22 -41.36 49.55 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 118.556 -1.258 . . . . 0.0 111.835 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' B' ' 123' ' ' SER . 53.7 p -69.2 -54.9 12.43 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -173.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.75 -49.94 9.22 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' B' ' 117' ' ' SER . 14.6 m -73.73 -38.42 64.78 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -175.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -102.32 -30.1 11.27 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.531 ' HA ' ' O ' ' B' ' 119' ' ' SER . 22.7 m 73.03 -51.84 0.71 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.308 1.443 . . . . 0.0 112.777 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -89.19 -40.34 12.94 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 89.53 175.05 46.02 Favored Glycine 0 CA--C 1.499 -0.923 0 CA-C-N 115.41 -0.814 . . . . 0.0 113.294 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 89.03 -78.83 1.65 Allowed Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.409 175.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 70.34 -103.88 1.25 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.9 m -100.56 91.76 4.81 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 172.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -129.74 -96.46 0.79 Allowed Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 86.63 -49.88 4.11 Favored Glycine 0 C--N 1.301 -1.4 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 152.15 155.24 6.95 Favored Glycine 0 N--CA 1.429 -1.828 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.2 t -135.11 5.28 3.28 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.8 0.809 . . . . 0.0 109.425 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.86 -142.48 4.52 Favored Glycine 0 N--CA 1.435 -1.384 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.598 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -164.32 156.38 28.25 Favored Glycine 0 N--CA 1.423 -2.192 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -72.77 -24.97 75.12 Favored Glycine 0 CA--C 1.499 -0.927 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 3.5 p -63.31 -37.54 87.66 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 123.634 0.774 . . . . 0.0 110.721 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.459 HD22 ' HG2' ' A' ' 83' ' ' ARG . 72.9 mt -61.7 -49.07 77.94 Favored 'General case' 0 C--O 1.254 1.313 0 CA-C-O 121.796 0.808 . . . . 0.0 109.661 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.649 ' OE1' ' HB2' ' A' ' 79' ' ' LEU 0.384 28.4 mm-40 -83.28 -9.53 59.06 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -172.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 139' ' ' CYS . . . . . 0.64 ' HA ' ' OE2' ' B' ' 142' ' ' GLU . 45.5 t -58.28 -22.87 54.36 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-O 121.762 0.791 . . . . 0.0 109.734 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.43 -32.86 54.88 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.304 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 144' ' ' ILE . 10.8 tpt -80.72 -23.02 39.77 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 123.894 0.877 . . . . 0.0 108.773 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.64 ' OE2' ' HA ' ' B' ' 139' ' ' CYS . 39.2 mt-10 -47.53 -26.17 1.34 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.2 m -55.94 -59.26 5.15 Favored 'General case' 0 C--O 1.259 1.599 0 CA-C-O 121.701 0.762 . . . . 0.0 111.138 174.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' B' ' 141' ' ' MET 0.291 2.6 pp -72.52 -23.59 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 O-C-N 121.356 -0.84 . . . . 0.0 111.674 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.633 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 29.2 mm -67.39 -38.55 80.99 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.801 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.675 172.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.433 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 15.2 tpp180 -59.14 -43.96 92.04 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.2 m -58.37 -48.16 81.51 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.598 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -72.07 -37.35 69.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.433 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.9 pp -68.34 -24.58 64.83 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.332 -0.855 . . . . 0.0 110.27 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.3 tpt -81.97 -61.45 1.91 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 173.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -120.62 108.46 14.06 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.958 0.409 . . . . 0.0 111.588 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.375 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 176.992 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.484 -1.903 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.06 121.6 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.68 0.752 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.513 ' H ' ' HD2' ' A' ' 3' ' ' ARG 0.272 0.2 OUTLIER -77.97 68.03 3.94 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.811 1.291 . . . . 0.0 112.906 -178.914 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.59 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 51.0 mtmt -141.92 90.13 2.24 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 105.289 -2.115 . . . . 0.0 105.289 176.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -14.58 40.2 Favored Glycine 0 C--N 1.319 -0.415 0 N-CA-C 114.404 0.521 . . . . 0.0 114.404 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.59 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 65.4 p-90 -63.91 -19.89 65.44 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.9 p-80 -61.94 -20.72 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.277 0.56 . . . . 0.0 111.393 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -82.5 -10.78 58.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -108.58 8.31 27.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.867 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.434 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -129.66 118.54 45.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 CA-C-O 121.317 0.579 . . . . 0.0 110.043 -177.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -85.8 153.1 22.51 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.287 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.93 -38.29 70.09 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-O 121.016 0.436 . . . . 0.0 110.765 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.506 ' CB ' ' HA ' ' B' ' 124' ' ' ASP . 7.2 m-20 -69.73 -27.72 65.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.434 HD12 HG23 ' A' ' 10' ' ' VAL . 2.6 tm? -73.38 -51.15 18.39 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.1 ptm180 -64.78 -38.28 90.45 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.837 -179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.412 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.8 t -70.01 -26.41 64.05 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -73.53 -36.17 65.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.538 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -63.43 -39.13 93.65 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 70.2 t -59.19 -49.93 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.405 0.682 . . . . 0.0 109.31 172.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -52.31 -46.33 65.95 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 124.569 1.148 . . . . 0.0 110.814 176.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' CE ' ' HB2' ' B' ' 118' ' ' ASP . 55.0 mttm -64.15 -42.36 96.81 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.277 177.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 19' ' ' VAL . 89.4 mt -54.63 -46.06 73.83 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -57.38 -49.97 78.43 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.758 175.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -68.03 -24.15 65.07 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.554 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.37 -46.34 16.21 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.003 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.56 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.9 tt -70.89 -29.33 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.958 0.885 . . . . 0.0 110.003 -178.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -127.14 90.74 48.41 Favored Pre-proline 0 N--CA 1.401 -2.901 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.025 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.412 ' HG3' ' HB2' ' B' ' 137' ' ' LEU . 15.9 Cg_endo -55.64 127.31 25.63 Favored 'Trans proline' 0 N--CA 1.447 -1.244 0 C-N-CA 122.398 2.065 . . . . 0.0 108.22 170.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 p -70.46 120.59 79.61 Favored Pre-proline 0 C--N 1.283 -2.308 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -87.17 -26.5 0.82 Allowed 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.067 1.178 . . . . 0.0 109.046 167.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -154.13 140.61 12.9 Favored Pre-proline 0 CA--C 1.495 -1.149 0 C-N-CA 125.471 1.508 . . . . 0.0 107.225 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -67.42 -19.48 49.24 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.276 1.318 . . . . 0.0 110.586 171.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.61 -6.81 59.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -13.99 59.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 122.333 1.063 . . . . 0.0 108.43 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.0 4.49 16.82 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.102 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.41 22.92 3.73 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.16 0.505 . . . . 0.0 110.987 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.482 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 10.2 t70 -87.56 -176.99 5.78 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.482 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.3 -17.44 62.46 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 119.823 1.192 . . . . 0.0 110.418 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 21.9 ttm180 -70.97 -20.31 62.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.404 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.68 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.8 tpp -66.94 -42.89 84.52 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.07 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.8 pt-20 -59.86 -29.53 68.36 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.062 -0.655 . . . . 0.0 109.869 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.42 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.3 t30 -73.61 -51.53 16.52 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 124.571 1.148 . . . . 0.0 110.346 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.22 -44.17 80.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.749 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.68 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -72.62 -33.33 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.893 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.071 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.57 -45.26 89.38 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.583 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.0 t80 -60.41 -50.49 73.37 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.696 174.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.88 -39.66 90.07 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 120.714 0.292 . . . . 0.0 110.951 -176.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.2 mttt -65.22 -45.24 85.5 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 123.373 0.669 . . . . 0.0 111.552 177.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.9 pttp -65.72 -39.25 90.98 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.152 0.501 . . . . 0.0 109.726 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 54' ' ' MET . 53.5 t -67.09 -52.39 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.807 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -55.59 -50.11 70.97 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 124.122 0.889 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.06 -40.7 97.42 Favored Glycine 0 CA--C 1.507 -0.461 0 O-C-N 123.607 0.567 . . . . 0.0 112.642 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.39 -54.26 48.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.031 0.443 . . . . 0.0 110.187 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.577 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.6 ptp -70.26 -30.51 67.56 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.28 -40.97 97.05 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.573 ' HA ' ' NZ ' ' A' ' 4' ' ' LYS . 17.0 mt-10 -78.74 -24.97 44.53 Favored 'General case' 0 C--N 1.313 -1.003 0 O-C-N 121.149 -0.969 . . . . 0.0 112.067 177.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.472 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 50.0 m -86.67 -18.8 30.37 Favored 'General case' 0 C--N 1.277 -2.561 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -175.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.25 160.14 14.82 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -98.59 -2.66 38.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.689 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.521 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 81.2 p -158.64 161.67 37.2 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.41 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -70.48 -29.74 66.36 Favored 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.915 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.77 -41.57 83.08 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 7.6 tp10 -62.97 -49.53 74.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 176.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -43.64 98.25 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.782 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.506 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -54.21 -48.88 70.55 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 172.625 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -65.0 -55.8 16.87 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.787 -172.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 54' ' ' MET . 2.1 pp -65.62 -30.16 70.84 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.538 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.92 -39.26 56.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 177.871 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.66 -32.94 73.14 Favored 'General case' 0 C--N 1.351 0.639 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.9 mm-40 -65.56 -47.08 77.05 Favored 'General case' 0 C--O 1.249 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 111.705 174.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -36.3 66.78 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.039 -1.064 . . . . 0.0 112.048 -177.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.8 tt -65.35 -37.8 80.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.785 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.5 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 12.5 t80 -54.25 -54.02 45.77 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 124.599 1.16 . . . . 0.0 111.907 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -65.41 -32.94 74.83 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.848 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.6 -41.02 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 51.5 mt-30 -64.27 -48.26 76.4 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.537 0.684 . . . . 0.0 110.622 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.84 -26.55 59.78 Favored 'General case' 0 N--CA 1.398 -3.057 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.6 tt0 -61.51 -48.63 80.17 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.737 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -66.51 -38.2 86.69 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.926 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -64.11 -47.85 78.4 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -63.48 -41.06 98.58 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 118.268 0.485 . . . . 0.0 111.543 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.402 ' HD2' ' N ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -71.46 -34.38 70.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.434 -178.846 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.621 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -77.22 -39.25 49.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.837 -177.245 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -98.23 -57.42 2.21 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -170.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.5 p -150.97 95.19 2.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -170.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -160.27 -34.56 0.05 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 168.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.5 mp . . . . . 0 C--O 1.249 1.051 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.681 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.096 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m 57.76 82.3 0.13 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 123.673 0.789 . . . . 0.0 110.563 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 80.2 mtp 59.98 68.92 0.74 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.64 0.776 . . . . 0.0 108.974 -175.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.1 m -70.01 161.56 29.82 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.446 -176.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -80.48 90.83 5.68 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 56.1 p90 -72.02 -176.07 1.64 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.732 -175.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.74 -50.85 0.86 Allowed Glycine 0 N--CA 1.417 -2.581 0 N-CA-C 109.246 -1.542 . . . . 0.0 109.246 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 34.1 p-10 -75.93 -14.09 60.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 113.639 -1.28 . . . . 0.0 111.767 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -68.37 -42.15 79.59 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.907 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.648 ' HA ' ' OD2' ' B' ' 113' ' ' ASP . 7.6 t -71.33 -31.27 67.2 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.728 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.79 -35.53 81.38 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.256 175.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 13.6 mm100 -64.55 -40.16 95.07 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ASP . . . . . 0.648 ' OD2' ' HA ' ' B' ' 110' ' ' THR . 38.2 m-20 -54.17 -48.51 70.85 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.39 0.431 . . . . 0.0 110.417 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.78 -46.12 88.26 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.802 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -57.71 -63.45 1.24 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.835 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.506 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 14.9 t -60.17 -39.29 85.9 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.7 t -71.74 -47.54 53.1 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.074 -174.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 15.9 m-20 -71.73 -54.2 11.05 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.72 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 5.5 m -60.47 -44.53 95.8 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -171.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.03 -19.96 39.33 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -176.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.9 t -76.29 -40.79 50.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -64.45 -50.75 66.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.427 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 64.3 p 56.71 -90.98 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.966 1.707 . . . . 0.0 112.55 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.506 ' HA ' ' CB ' ' A' ' 13' ' ' ASP . 6.6 p-10 -142.56 20.1 2.03 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.71 0.767 . . . . 0.0 110.314 177.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -132.79 -123.63 2.45 Favored Glycine 0 N--CA 1.432 -1.587 0 N-CA-C 109.342 -1.503 . . . . 0.0 109.342 177.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 97.52 131.87 7.24 Favored Glycine 0 N--CA 1.434 -1.437 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.352 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -113.82 12.14 22.75 Favored Glycine 0 N--CA 1.438 -1.225 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 175.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.1 m -64.87 -46.41 81.91 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 122.824 0.449 . . . . 0.0 109.792 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 71.93 -111.82 3.79 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.503 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.96 149.95 21.82 Favored Glycine 0 N--CA 1.42 -2.367 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 178.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 169.51 108.65 0.21 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 34.5 t -174.45 145.84 1.0 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.23 176.3 22.8 Favored Glycine 0 N--CA 1.437 -1.283 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 162.22 -64.25 0.26 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.701 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 141.83 -170.37 24.88 Favored Glycine 0 N--CA 1.44 -1.038 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.682 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 36.5 m -93.74 90.71 6.68 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-O 121.723 0.773 . . . . 0.0 111.503 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.412 ' HB2' ' HG3' ' A' ' 28' ' ' PRO . 7.7 mp -99.32 -15.6 18.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.633 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' B' ' 139' ' ' CYS . 0.0 OUTLIER -70.12 -62.6 1.32 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.203 0.445 . . . . 0.0 112.203 -177.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 139' ' ' CYS . . . . . 0.42 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 45.7 m 23.57 -83.23 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 128.316 2.646 . . . . 0.0 116.146 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -39.88 85.26 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.847 1.259 . . . . 0.0 110.233 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.737 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 21.3 ttt -66.47 -23.68 66.31 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.987 -174.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.55 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 42.9 mt-10 -57.71 -26.74 62.19 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 26.0 m -66.88 -49.11 66.68 Favored 'General case' 0 C--O 1.26 1.614 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.975 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.9 pp -71.12 -28.06 31.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.834 0.826 . . . . 0.0 110.183 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.56 ' CG2' HD11 ' A' ' 26' ' ' ILE . 12.1 mm -67.79 -44.48 85.58 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.252 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.138 174.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -60.62 -39.1 86.97 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 22.9 t -61.24 -50.63 72.28 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.66 -53.16 61.24 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.454 1.101 . . . . 0.0 112.588 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.502 HD12 ' N ' ' B' ' 150' ' ' MET . 3.7 pp -72.71 -31.18 64.8 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -173.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.502 ' N ' HD12 ' B' ' 149' ' ' LEU . 49.5 tpp -75.91 -43.41 45.31 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.454 -174.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -151.4 131.9 13.84 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.288 0.566 . . . . 0.0 110.882 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.518 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 179.808 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.247 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 69.6 t 78.96 120.78 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 C-N-CA 124.395 1.078 . . . . 0.0 110.058 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.423 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 5.0 tpt180 -81.05 117.3 21.53 Favored 'General case' 0 N--CA 1.413 -2.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.598 -174.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -127.81 114.87 17.79 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.91 -29.98 8.77 Favored Glycine 0 N--CA 1.477 1.37 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.489 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 62.4 p-90 -63.98 -17.84 63.68 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -69.35 -13.47 62.39 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.876 -177.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -89.61 -2.98 58.48 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.485 0.659 . . . . 0.0 109.788 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -95.62 -13.17 24.56 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.528 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.71 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -104.77 110.77 31.79 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.722 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.8 m -73.3 149.61 42.55 Favored 'General case' 0 C--N 1.279 -2.459 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -56.6 -38.48 72.08 Favored 'General case' 0 C--O 1.209 -1.049 0 O-C-N 123.556 0.535 . . . . 0.0 109.654 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.89 -29.02 68.02 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.64 -52.97 9.33 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.2 ptm180 -58.66 -41.79 86.92 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.178 176.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.5 t -69.21 -25.4 64.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.442 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 15.2 t60 -67.98 -38.95 83.31 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.432 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -67.8 -37.72 82.38 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.811 177.281 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.2 t -57.04 -47.87 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-O 121.548 0.69 . . . . 0.0 109.384 174.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.2 t-80 -53.93 -50.66 65.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.503 176.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' B' ' 115' ' ' LEU . 54.8 mttm -64.6 -37.11 86.45 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.6 mt -55.58 -43.92 76.4 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.342 0.401 . . . . 0.0 109.941 176.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' HB3' ' A' ' 43' ' ' LEU . 2.3 t -60.08 -53.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 123.684 0.615 . . . . 0.0 111.905 175.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -65.48 -27.53 68.56 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.817 0.341 . . . . 0.0 111.624 -176.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.33 -43.2 19.41 Favored 'General case' 0 N--CA 1.424 -1.765 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.947 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.588 HD11 HG23 ' B' ' 145' ' ' ILE . 1.8 tt -70.22 -39.93 77.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.405 0 CA-C-O 121.606 0.717 . . . . 0.0 109.66 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.44 ' CD2' ' HD3' ' A' ' 39' ' ' ARG . 4.4 m-85 -125.66 102.29 29.28 Favored Pre-proline 0 N--CA 1.401 -2.887 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.759 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 51.1 Cg_exo -48.86 140.89 22.59 Favored 'Trans proline' 0 N--CA 1.438 -1.766 0 C-N-CA 123.294 2.663 . . . . 0.0 111.347 175.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.45 109.92 63.49 Favored Pre-proline 0 N--CA 1.382 -3.847 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.481 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.07 -26.92 4.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 121.92 1.747 . . . . 0.0 110.622 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -156.42 143.23 13.46 Favored Pre-proline 0 N--CA 1.433 -1.322 0 N-CA-C 106.22 -1.77 . . . . 0.0 106.22 -176.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.91 -21.82 42.87 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.612 2.208 . . . . 0.0 113.761 176.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -18.02 63.64 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.561 -0.712 . . . . 0.0 112.306 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.3 -14.76 63.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.652 0.739 . . . . 0.0 110.173 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.485 ' O ' ' HG2' ' A' ' 40' ' ' MET . 13.2 mt -91.32 1.78 56.86 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.569 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -133.16 14.91 4.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 122.076 0.941 . . . . 0.0 109.677 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 21.3 t70 -79.38 174.29 11.72 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.302 179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -25.89 63.01 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.543 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.44 ' HD3' ' CD2' ' A' ' 27' ' ' PHE . 23.9 ttm180 -61.03 -27.87 68.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.624 175.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.527 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 11.1 tpp -62.75 -42.49 99.7 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.773 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.54 -33.31 72.49 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 119.589 -0.844 . . . . 0.0 109.689 -176.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -71.97 -45.54 60.63 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.454 1.101 . . . . 0.0 110.479 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.485 ' HB3' HG22 ' A' ' 23' ' ' VAL . 95.5 mt -67.31 -45.32 76.81 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.327 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.513 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -72.83 -32.19 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 C-N-CA 120.534 -0.467 . . . . 0.0 110.239 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.89 -43.67 98.37 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.2 t80 -61.47 -51.45 68.61 Favored 'General case' 0 C--O 1.208 -1.085 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.975 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.24 87.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.629 0.252 . . . . 0.0 111.334 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -64.8 -42.64 94.88 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.4 pttp -70.5 -35.59 73.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.272 0.558 . . . . 0.0 110.208 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 46' ' ' TYR . 54.6 t -65.32 -49.68 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.162 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -55.43 -51.9 65.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.271 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.34 -38.85 91.66 Favored Glycine 0 C--N 1.333 0.393 0 O-C-N 123.642 0.589 . . . . 0.0 112.975 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.14 -54.12 45.68 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.254 0.55 . . . . 0.0 111.054 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 1.2 ptp -69.49 -27.82 65.53 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -62.47 -54.14 44.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.92 -17.81 60.5 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.184 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.0 t -79.72 -19.64 48.36 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 120.741 0.305 . . . . 0.0 110.96 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.48 165.25 12.09 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -175.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.43 6.12 37.46 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.284 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.489 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 7.2 t -173.59 162.66 4.21 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.71 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.95 -30.37 71.35 Favored 'General case' 0 C--O 1.168 -3.197 0 O-C-N 123.804 0.69 . . . . 0.0 110.77 178.18 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.12 -47.39 78.21 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.891 0.853 . . . . 0.0 109.543 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -71.6 -43.8 65.58 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.494 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.402 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.62 -40.12 94.93 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.646 ' CE1' HD13 ' B' ' 115' ' ' LEU . 5.1 t80 -60.6 -47.05 87.93 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.207 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.65 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 40.5 t-80 -63.35 -53.76 47.5 Favored 'General case' 0 C--O 1.205 -1.253 0 O-C-N 123.716 0.635 . . . . 0.0 111.524 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.5 pp -67.87 -30.47 69.84 Favored 'General case' 0 C--O 1.256 1.43 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.167 -174.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.432 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.23 -44.05 63.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 174.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -52.95 -33.0 48.91 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.394 0.678 . . . . 0.0 111.717 173.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 31.3 mt-10 -73.38 -44.63 58.17 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.549 0.214 . . . . 0.0 110.845 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.12 -37.74 78.49 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 118.687 -1.205 . . . . 0.0 110.509 -179.432 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.633 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -36.77 77.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.8 -54.29 36.19 Favored 'General case' 0 C--O 1.258 1.527 0 C-N-CA 124.505 1.122 . . . . 0.0 110.379 174.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.36 -31.82 70.49 Favored 'General case' 0 C--O 1.204 -1.334 0 O-C-N 123.8 0.688 . . . . 0.0 110.771 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.539 ' HA ' ' HE1' ' B' ' 141' ' ' MET . 1.3 mp -63.15 -46.93 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 O-C-N 123.389 0.431 . . . . 0.0 109.955 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 52.5 mt-30 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.699 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.578 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -74.07 -28.22 61.28 Favored 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.421 -176.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -62.49 -52.79 62.1 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.656 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -62.03 -44.54 96.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.927 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.3 OUTLIER -62.63 -53.63 51.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.698 -178.099 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.3 pt-20 -76.35 -34.77 58.95 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -28.71 60.89 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.029 -178.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -70.99 -44.27 66.31 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -70.54 -45.69 65.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.449 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 31.6 t 79.5 85.14 0.06 Allowed 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 125.324 1.45 . . . . 0.0 111.103 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' A' ' 81' ' ' GLU . 2.0 ptm180 -110.49 1.23 18.11 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.084 177.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--N 1.309 -1.159 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.976 -177.262 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.667 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 24.6 m 67.33 -74.71 0.07 Allowed 'General case' 0 C--O 1.245 0.839 0 C-N-CA 125.063 1.345 . . . . 0.0 111.238 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 28.0 ttt -146.72 78.96 1.52 Allowed 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 121.725 0.774 . . . . 0.0 110.745 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 50.8 m -129.39 -1.55 5.0 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.961 170.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 30.3 m80 66.14 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.986 1.714 . . . . 0.0 109.93 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.421 ' HB2' ' OE1' ' B' ' 109' ' ' GLN . 72.8 m-85 -119.61 -58.86 1.87 Allowed 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 172.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.2 -44.12 3.29 Favored Glycine 0 CA--C 1.495 -1.173 0 CA-C-N 114.539 -1.21 . . . . 0.0 113.803 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.558 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 32.8 p-10 -77.05 -11.1 59.76 Favored 'General case' 0 C--N 1.278 -2.542 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -170.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.421 ' OE1' ' HB2' ' B' ' 106' ' ' TYR . 5.1 pm0 -62.04 -35.02 77.34 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 123.461 0.476 . . . . 0.0 110.995 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 18.1 m -65.46 -40.97 93.85 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-O 121.244 0.545 . . . . 0.0 109.949 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.54 -40.45 85.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.866 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.558 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 25.0 mt-30 -64.52 -39.32 93.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.575 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.92 -50.96 68.79 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.647 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -42.23 90.94 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 123.166 0.291 . . . . 0.0 111.386 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.646 HD13 ' CE1' ' A' ' 65' ' ' TYR . 16.7 mt -51.44 -63.04 1.26 Allowed 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.643 0.59 . . . . 0.0 110.58 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 12.9 m -65.96 -28.48 68.93 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.495 -1.229 . . . . 0.0 112.298 -172.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' B' ' 121' ' ' SER . 51.0 m -68.3 -40.66 81.66 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 120.631 -0.428 . . . . 0.0 109.957 176.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -76.15 -47.85 22.76 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.659 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' B' ' 123' ' ' SER . 60.7 p -73.73 -56.58 4.81 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.8 -54.54 4.82 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.44 ' HB3' ' O ' ' B' ' 117' ' ' SER . 26.7 t -63.34 -43.11 98.68 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -174.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 64.5 m80 -101.66 -45.69 5.18 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.077 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' B' ' 119' ' ' SER . 67.9 m 74.99 8.6 4.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.611 1.165 . . . . 0.0 113.244 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -122.12 156.43 33.63 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -145.27 154.38 25.88 Favored Glycine 0 N--CA 1.429 -1.792 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.58 171.5 34.77 Favored Glycine 0 N--CA 1.423 -2.172 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' GLY . . . . . 0.483 ' HA3' ' CD1' ' A' ' 35' ' ' LEU . . . -94.21 111.54 4.18 Favored Glycine 0 N--CA 1.428 -1.852 0 C-N-CA 120.459 -0.876 . . . . 0.0 112.524 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.7 m -88.7 142.45 27.67 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -86.99 116.33 4.44 Favored Glycine 0 N--CA 1.436 -1.364 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -92.27 -166.5 39.36 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.862 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -119.12 32.04 5.25 Favored Glycine 0 C--N 1.309 -0.971 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 5.2 p -89.02 -69.28 0.72 Allowed 'General case' 0 N--CA 1.422 -1.868 0 C-N-CA 123.39 0.676 . . . . 0.0 111.146 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 116.16 160.99 12.48 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -107.84 134.06 12.0 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.15 32.96 7.52 Favored Glycine 0 N--CA 1.433 -1.549 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.098 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.2 p -149.95 -76.36 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 5.9 mp -65.4 -49.8 67.91 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 121.251 0.548 . . . . 0.0 111.12 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -71.42 -40.97 70.12 Favored 'General case' 0 C--O 1.191 -1.985 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.184 178.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 48.0 t -56.31 -39.95 73.58 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.485 0.714 . . . . 0.0 110.915 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -57.08 14.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.982 0.896 . . . . 0.0 111.103 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.656 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.8 ttt -77.02 -14.6 59.81 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.436 -173.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 13.4 tm-20 -56.55 -27.01 56.61 Favored 'General case' 0 C--O 1.2 -1.546 0 C-N-CA 124.096 0.958 . . . . 0.0 112.422 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 21.7 t -62.27 -49.95 73.65 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-N 117.97 0.35 . . . . 0.0 110.755 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.44 HD11 ' CG ' ' B' ' 141' ' ' MET 0.261 2.7 pp -70.29 -24.88 26.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.201 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.905 176.364 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.588 HG23 HD11 ' A' ' 26' ' ' ILE . 16.9 mm -63.13 -43.16 98.74 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.398 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 78.0 mtp180 -56.84 -45.1 82.59 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.304 0.641 . . . . 0.0 110.625 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 6.1 p -60.11 -36.64 77.91 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 119.542 -0.863 . . . . 0.0 113.255 176.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -76.11 -44.95 36.16 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.231 -0.988 . . . . 0.0 112.295 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.445 HD12 ' N ' ' B' ' 150' ' ' MET 0.262 3.1 pp -70.24 -33.55 71.78 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.211 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.445 ' N ' HD12 ' B' ' 149' ' ' LEU . 50.5 ttm -70.53 -40.73 73.27 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.242 0.544 . . . . 0.0 111.039 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -92.61 117.67 30.22 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.447 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.476 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.115 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.759 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.2 m -127.57 148.46 32.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.467 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -116.06 93.09 4.1 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-O 122.287 1.041 . . . . 0.0 110.108 179.313 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 10.4 ptpt -92.04 120.48 32.72 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.215 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.12 -18.92 36.44 Favored Glycine 0 N--CA 1.464 0.506 0 N-CA-C 116.156 1.223 . . . . 0.0 116.156 -168.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -76.01 -2.14 29.15 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 117.48 0.64 . . . . 0.0 112.087 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -62.53 -21.33 65.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.449 0.642 . . . . 0.0 110.793 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -86.2 -10.55 54.49 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.809 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -102.85 5.21 38.47 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.867 0.841 . . . . 0.0 110.09 -177.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.3 p -129.31 110.79 21.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.5 m -83.22 151.04 25.84 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.456 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.6 tm0? -51.77 -38.8 56.98 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.934 0.894 . . . . 0.0 111.33 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -69.73 -30.05 67.56 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.409 HD12 HG23 ' A' ' 10' ' ' VAL . 2.9 tm? -74.76 -47.69 29.71 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 -177.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.538 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -64.93 -41.25 95.7 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.621 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 t -69.6 -25.35 63.92 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.596 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 15.6 t60 -75.31 -36.86 61.04 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.888 177.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 HD21 ' A' ' 68' ' ' LEU . 1.4 mp -63.29 -37.63 87.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 173.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 15' ' ' ARG . 99.5 t -60.21 -45.78 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 19.4 t-80 -55.77 -47.04 77.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.881 177.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -66.49 -39.21 88.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.78 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 26' ' ' ILE . 28.8 mt -53.47 -48.35 68.94 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 123.547 0.529 . . . . 0.0 109.799 173.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.431 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.8 t -54.67 -48.64 71.72 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 O-C-N 124.237 0.96 . . . . 0.0 111.612 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -69.37 -24.19 63.85 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -44.55 16.24 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.503 175.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.679 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.09 -29.61 37.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.958 0.885 . . . . 0.0 109.517 -177.743 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -123.46 84.62 52.65 Favored Pre-proline 0 N--CA 1.403 -2.822 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.899 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.424 ' CG ' ' HB2' ' B' ' 137' ' ' LEU . 10.4 Cg_endo -53.87 115.95 2.68 Favored 'Trans proline' 0 N--CA 1.443 -1.468 0 C-N-CA 122.396 2.064 . . . . 0.0 109.072 171.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.47 118.05 67.92 Favored Pre-proline 0 N--CA 1.394 -3.225 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -168.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -78.92 -25.31 6.28 Favored 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 121.698 1.599 . . . . 0.0 109.537 172.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -167.42 145.43 4.0 Favored Pre-proline 0 CA--C 1.506 -0.731 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.23 -22.95 74.97 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.851 2.367 . . . . 0.0 114.167 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.19 -5.91 53.24 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.029 -1.044 . . . . 0.0 111.778 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.42 -8.36 59.05 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 40' ' ' MET . 28.6 mt -89.55 7.09 38.07 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.55 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.68 22.12 4.27 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.197 0.998 . . . . 0.0 108.944 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.597 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.3 t70 -95.61 172.68 7.91 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.058 -176.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -68.12 -22.84 64.86 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 122.794 0.437 . . . . 0.0 111.476 -178.438 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -79.05 -17.16 55.73 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.713 0.768 . . . . 0.0 109.416 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.597 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.3 tpp -62.98 -43.14 99.6 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.124 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -56.04 -38.84 71.12 Favored 'General case' 0 C--O 1.193 -1.873 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.082 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.407 HD21 HD22 ' B' ' 149' ' ' LEU . 2.8 t30 -68.09 -45.0 74.99 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.782 0.833 . . . . 0.0 111.546 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 37.4 mt -67.89 -43.44 79.31 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.184 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 p -73.25 -33.22 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.263 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.07 -44.05 97.51 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.517 0.675 . . . . 0.0 109.392 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.679 ' CE1' HG13 ' A' ' 26' ' ' ILE . 3.9 t80 -61.0 -47.19 87.59 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.263 174.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.13 97.32 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.501 -177.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -63.03 -46.3 88.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.898 176.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 19.7 pttp -64.06 -39.13 93.4 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 121.021 0.439 . . . . 0.0 110.528 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.58 -50.39 66.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.134 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -57.01 -47.79 80.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.719 0.807 . . . . 0.0 109.896 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -42.83 93.66 Favored Glycine 0 N--CA 1.446 -0.682 0 O-C-N 123.666 0.603 . . . . 0.0 112.632 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.35 -54.11 50.53 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.368 0.604 . . . . 0.0 110.564 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.521 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 ptp -67.16 -33.14 74.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.61 -50.96 71.86 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.01 -18.01 60.91 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.842 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -75.58 -54.52 6.87 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 122.374 0.269 . . . . 0.0 111.446 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.53 168.32 7.58 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.19 9.29 15.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.027 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.453 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 73.2 m -161.15 153.81 20.66 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 175.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.539 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.39 -39.58 74.46 Favored 'General case' 0 C--O 1.182 -2.472 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.461 -177.802 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.453 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 2.8 p-10 -62.78 -32.47 73.64 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 124.545 1.138 . . . . 0.0 109.479 176.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -71.96 -46.72 56.4 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.156 174.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.45 99.17 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.58 -49.06 77.63 Favored 'General case' 0 C--O 1.196 -1.731 0 C-N-CA 125.235 1.414 . . . . 0.0 109.381 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -66.12 -48.39 71.0 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 122.535 0.334 . . . . 0.0 111.669 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.444 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.8 pp -69.35 -29.96 67.88 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.642 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.548 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.93 -37.41 58.75 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.686 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.578 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.04 -35.93 80.09 Favored 'General case' 0 C--O 1.204 -1.317 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 7.2 mm-40 -59.89 -52.04 67.13 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.803 0.841 . . . . 0.0 110.263 172.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.73 -47.74 84.46 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.398 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.618 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.3 tt -68.16 -37.23 77.8 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.157 -177.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 13.0 t80 -56.88 -54.11 50.28 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 125.269 1.428 . . . . 0.0 111.395 176.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.4 ptpt -66.23 -32.28 73.61 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.411 -177.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.46 -39.54 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.684 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.0 mt-30 -66.2 -46.45 77.25 Favored 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.922 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.642 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.1 ptpt -75.2 -27.99 59.82 Favored 'General case' 0 N--CA 1.401 -2.92 0 C-N-CA 119.41 -0.916 . . . . 0.0 112.369 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 10.5 tp10 -57.54 -52.89 63.57 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.525 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -66.59 -41.55 88.33 Favored 'General case' 0 C--O 1.25 1.101 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.77 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' N ' HD12 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -60.77 -53.8 52.92 Favored 'General case' 0 N--CA 1.416 -2.165 0 C-N-CA 123.251 0.62 . . . . 0.0 110.433 -177.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -73.35 -32.31 64.46 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -175.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.518 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -65.6 -34.11 77.47 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.245 179.673 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.421 ' HG2' ' CD2' ' B' ' 137' ' ' LEU . 19.7 tpt180 -76.93 -35.92 56.97 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 121.619 0.723 . . . . 0.0 109.363 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -70.16 -58.43 3.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.066 -172.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.0 p -128.09 -64.42 0.96 Allowed 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -168.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.518 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 7.3 ptm180 -52.83 -26.53 14.83 Favored 'General case' 0 C--N 1.274 -2.691 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.175 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' LYS . 7.2 mp . . . . . 0 C--O 1.257 1.499 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 173.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' B' ' 104' ' ' SER . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 19.3 t -94.09 -19.51 20.76 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.061 0.458 . . . . 0.0 110.225 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.0 ttt -118.98 -48.92 2.43 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.498 ' O ' ' HA2' ' B' ' 101' ' ' GLY . 23.2 t -94.78 92.12 6.81 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 171.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -74.35 172.2 12.32 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.975 -1.012 . . . . 0.0 113.352 -169.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -103.76 49.23 0.83 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 105.838 -1.912 . . . . 0.0 105.838 172.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.88 83.12 0.16 Allowed Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.124 -175.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.515 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 28.4 p30 -101.3 14.44 31.96 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 123.851 0.86 . . . . 0.0 111.355 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -65.15 -36.75 85.22 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -170.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 33.9 m -61.63 -45.07 95.63 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 121.476 0.655 . . . . 0.0 109.417 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.57 -45.94 56.77 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.845 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 14.0 mm100 -60.48 -42.94 97.31 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.24 -47.6 79.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.426 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.98 -44.16 82.4 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.75 0.656 . . . . 0.0 109.624 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.48 -60.62 3.5 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.867 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 17.5 m -57.05 -48.79 77.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.86 0.362 . . . . 0.0 111.837 -173.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 m -69.94 -52.61 23.03 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.047 -174.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.18 -40.88 59.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.566 -174.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.596 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 33.1 t -64.27 -53.95 41.02 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 84.3 mt -67.68 -26.57 66.26 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 30.8 m -76.39 -47.78 22.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.059 0.457 . . . . 0.0 110.748 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -73.37 -29.58 62.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 68.2 p -79.41 -7.28 58.27 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.475 0.655 . . . . 0.0 110.474 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -86.61 -45.52 10.95 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.533 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -82.6 -79.41 1.0 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.927 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 169.83 45.24 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.963 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.816 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 52.37 41.14 54.71 Favored Glycine 0 N--CA 1.465 0.573 0 O-C-N 123.907 0.416 . . . . 0.0 114.088 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 9.2 m -106.17 117.37 33.87 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 101.59 3.18 53.11 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -76.24 118.54 5.35 Favored Glycine 0 N--CA 1.439 -1.161 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -164.99 150.61 18.77 Favored Glycine 0 N--CA 1.424 -2.159 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.777 -177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 20.4 t -170.68 162.03 7.68 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 104.913 -2.254 . . . . 0.0 104.913 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -127.28 -171.38 13.04 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.076 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -161.1 -58.38 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 127.64 -160.87 21.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.541 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.9 m -84.51 35.63 0.56 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.708 0.765 . . . . 0.0 109.973 -178.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.424 ' HB2' ' CG ' ' A' ' 28' ' ' PRO . 45.1 mt -85.45 -24.27 27.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.715 -175.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -42.94 98.36 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -175.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 2.8 p -69.13 -2.26 9.81 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -111.12 -41.76 4.11 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 173.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.525 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 14.5 tpt -57.95 -37.94 75.06 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.448 1.099 . . . . 0.0 109.822 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.528 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.0 mt-10 -48.98 -26.86 2.76 Favored 'General case' 0 C--O 1.187 -2.234 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 177.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.4 m -62.04 -60.33 3.77 Favored 'General case' 0 C--O 1.27 2.134 0 CA-C-N 119.391 0.996 . . . . 0.0 111.249 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.522 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.7 pp -72.53 -25.53 22.95 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 CA-C-O 122.492 1.139 . . . . 0.0 110.532 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.595 ' CG2' HD11 ' A' ' 26' ' ' ILE . 5.9 mm -70.48 -37.58 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.093 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.431 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.489 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 32.3 ttm180 -64.32 -36.55 84.48 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 m -57.83 -49.02 78.08 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.186 173.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -68.62 -41.63 79.21 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.489 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -77.27 -20.41 55.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.7 ttt -75.33 -31.62 60.64 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -89.7 171.16 9.85 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.62 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.665 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.624 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 86.8 t -102.79 133.56 46.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.463 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 10.1 tpt180 -84.99 108.99 17.86 Favored 'General case' 0 N--CA 1.414 -2.235 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.102 -172.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -121.67 120.17 33.94 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.69 -8.52 72.45 Favored Glycine 0 C--N 1.296 -1.692 0 C-N-CA 120.054 -1.069 . . . . 0.0 114.552 -173.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -75.74 -18.56 59.52 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.389 19.6 p80 -72.32 -0.52 12.53 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -174.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -90.56 -6.32 54.85 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.152 0.501 . . . . 0.0 109.878 173.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -106.72 11.99 29.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.206 0.527 . . . . 0.0 112.136 -176.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.474 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.7 p -129.05 109.9 19.67 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 CA-C-O 122.119 0.961 . . . . 0.0 109.51 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.0 m -73.87 150.74 40.75 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.842 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.66 -38.36 84.64 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -61.29 -37.25 82.5 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.592 176.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.435 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -73.35 -45.51 54.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -173.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.546 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -70.41 -43.35 70.16 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.199 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.4 t -65.77 -28.07 68.75 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -64.97 -48.22 74.78 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.466 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -60.56 -38.75 85.57 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.823 177.415 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.0 t -57.46 -47.34 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.121 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.552 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.2 t-80 -62.98 -38.65 92.0 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.798 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.9 -35.6 77.04 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 119.11 -1.036 . . . . 0.0 111.538 175.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.58 -42.29 78.42 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.5 t -58.59 -50.25 79.67 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.713 173.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.4 mt-30 -62.52 -30.49 71.33 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.856 0.36 . . . . 0.0 111.64 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.35 -43.42 21.17 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.494 HG13 HG12 ' B' ' 145' ' ' ILE . 3.1 tt -70.68 -32.96 51.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.953 0.882 . . . . 0.0 109.62 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.556 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 79.1 t80 -125.37 84.96 59.13 Favored Pre-proline 0 N--CA 1.407 -2.594 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.531 -176.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -59.66 85.38 0.07 OUTLIER 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 123.073 2.516 . . . . 0.0 108.804 168.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -63.75 140.61 97.85 Favored Pre-proline 0 N--CA 1.424 -1.744 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -170.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.4 -21.19 6.52 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.945 2.43 . . . . 0.0 111.532 174.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -153.68 135.16 8.75 Favored Pre-proline 0 CA--C 1.505 -0.759 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -53.47 -24.25 27.68 Favored 'Trans proline' 0 CA--C 1.558 1.713 0 C-N-CA 122.726 2.284 . . . . 0.0 113.812 175.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.15 -14.7 59.36 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.826 -0.546 . . . . 0.0 111.68 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.66 -10.95 59.87 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.934 0.873 . . . . 0.0 109.494 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.2 mt -85.32 3.01 41.66 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.371 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.76 15.18 4.36 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.762 0.792 . . . . 0.0 110.052 177.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 36.3 t70 -74.93 175.63 7.91 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.947 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.06 -21.66 62.22 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.477 0.656 . . . . 0.0 110.417 178.237 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.428 ' NH1' ' HE1' ' A' ' 27' ' ' PHE . 60.0 ttt180 -75.52 -16.0 60.33 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.567 0.699 . . . . 0.0 109.2 176.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.662 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.58 -40.9 93.26 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.456 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -58.48 -32.13 68.48 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.233 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -72.02 -49.67 34.93 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 124.27 1.028 . . . . 0.0 110.774 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.71 -43.32 84.65 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.867 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.662 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -73.36 -28.05 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.25 -49.93 75.09 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.428 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -57.83 -46.16 85.13 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.998 175.336 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.31 90.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.512 0.196 . . . . 0.0 111.456 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -63.17 -44.62 94.93 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.205 0.602 . . . . 0.0 112.182 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.1 pttp -68.22 -36.95 80.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.188 0.518 . . . . 0.0 110.111 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.2 t -66.99 -47.72 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.612 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -55.52 -49.79 71.7 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.655 0.782 . . . . 0.0 108.999 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.44 84.84 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.922 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.12 -54.69 22.39 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.617 -0.343 . . . . 0.0 110.728 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.462 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.8 OUTLIER -66.78 -27.53 67.66 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.449 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.33 -53.75 47.73 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -67.7 -34.31 76.62 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.35 0.595 . . . . 0.0 111.574 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 33.8 m -68.53 -24.51 64.66 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.31 161.25 14.76 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -107.5 5.4 27.11 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.65 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.8 p -163.98 157.53 18.59 Favored 'General case' 0 CA--C 1.477 -1.833 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.27 -28.55 63.19 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.126 -178.677 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -67.06 -40.11 87.03 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -64.17 -45.27 89.15 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.463 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -43.6 92.95 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.889 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.693 ' CE1' HD13 ' B' ' 115' ' ' LEU . 10.9 t80 -60.68 -47.43 86.29 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.505 1.122 . . . . 0.0 109.944 178.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -63.38 -50.58 69.33 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.3 pp -70.55 -30.23 66.9 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.653 -175.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.408 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.8 OUTLIER -70.51 -43.28 69.98 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.52 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.562 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -55.34 -41.23 72.21 Favored 'General case' 0 C--O 1.202 -1.418 0 O-C-N 123.795 0.684 . . . . 0.0 110.795 173.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -56.96 -49.66 75.0 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 123.399 0.679 . . . . 0.0 111.718 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -36.3 68.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.573 -177.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.562 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.7 tt -69.61 -35.69 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.4 t80 -56.65 -52.5 64.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.975 1.31 . . . . 0.0 110.593 175.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.02 -32.4 73.6 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.375 -177.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.37 -43.01 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 O-C-N 123.244 0.34 . . . . 0.0 110.743 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.9 mt-30 -63.06 -52.71 61.71 Favored 'General case' 0 CA--C 1.491 -1.311 0 O-C-N 123.757 0.661 . . . . 0.0 110.679 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.8 ptpt -72.39 -27.93 62.68 Favored 'General case' 0 N--CA 1.409 -2.493 0 C-N-CA 119.184 -1.006 . . . . 0.0 112.908 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 40.4 tp10 -57.48 -52.89 63.56 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.1 -43.18 75.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.591 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 74.2 mm-40 -61.63 -52.93 62.32 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.9 pt-20 -71.46 -32.67 68.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.411 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -71.54 -27.58 63.28 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.198 0.523 . . . . 0.0 110.458 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -73.11 -49.89 25.86 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.004 172.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 18.0 ptp180 -89.29 -56.18 3.37 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -171.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.9 p -134.02 -6.99 2.71 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 -167.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.538 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 2.4 ptp180 -87.55 -16.66 34.0 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 116.958 -1.897 . . . . 0.0 109.856 177.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.509 HD22 ' HG3' ' A' ' 86' ' ' ARG . 4.0 mm? . . . . . 0 C--O 1.258 1.549 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.346 0 N-CA-C 111.665 -0.574 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 32.1 t -85.61 81.31 8.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 59.0 ttp -85.78 -52.07 6.0 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.691 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 25.2 t -74.22 115.02 13.24 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 177.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -91.23 164.89 13.73 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 120.967 0.413 . . . . 0.0 111.036 -173.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -83.91 26.0 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 C-N-CA 124.278 1.031 . . . . 0.0 109.506 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.11 57.21 4.86 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.833 -174.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.513 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 38.2 p30 -83.77 0.51 47.03 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.42 -43.19 54.8 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 124.797 1.239 . . . . 0.0 113.408 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.8 t -67.6 -35.83 79.7 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.584 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.41 -45.65 53.31 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.688 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 13.2 mm100 -64.22 -40.81 96.81 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.096 -178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.36 -40.85 85.8 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.634 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 67.8 tp -56.28 -53.69 54.2 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.693 HD13 ' CE1' ' A' ' 65' ' ' TYR . 26.4 mt -51.59 -65.24 0.59 Allowed 'General case' 0 C--O 1.205 -1.261 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.274 176.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.7 m -59.37 -31.8 69.55 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.96 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 56.7 m -69.1 -47.89 63.99 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.124 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -76.5 -34.41 58.61 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.868 -176.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 66.7 p -73.89 -54.17 8.54 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.1 mt -81.79 -13.07 58.2 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' B' ' 124' ' ' ASP . 73.9 m -69.3 -11.52 60.88 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.846 0.355 . . . . 0.0 111.9 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -61.13 -31.89 71.59 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 173.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.7 m -95.16 -61.74 1.43 Allowed 'General case' 0 N--CA 1.422 -1.873 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.613 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.491 ' O ' ' HA ' ' B' ' 121' ' ' SER . 3.6 p30 -150.48 143.7 24.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 131.98 174.2 13.56 Favored Glycine 0 C--N 1.307 -1.04 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -122.06 19.85 8.18 Favored Glycine 0 C--N 1.31 -0.873 0 C-N-CA 121.016 -0.611 . . . . 0.0 111.973 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -70.02 120.16 9.4 Favored Glycine 0 N--CA 1.438 -1.18 0 N-CA-C 112.015 -0.434 . . . . 0.0 112.015 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.5 t -134.26 5.12 3.5 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.052 0.454 . . . . 0.0 110.021 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -63.88 149.42 50.59 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.186 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -144.11 -81.73 0.05 OUTLIER Glycine 0 N--CA 1.433 -1.559 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.774 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 166.24 -176.91 41.43 Favored Glycine 0 N--CA 1.438 -1.171 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.5 t -96.7 -22.59 16.9 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.9 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.51 -118.98 5.25 Favored Glycine 0 N--CA 1.426 -1.974 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -173.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 164.54 -70.14 0.2 Allowed Glycine 0 N--CA 1.438 -1.193 0 C-N-CA 119.079 -1.534 . . . . 0.0 113.713 175.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 127.99 -137.95 10.1 Favored Glycine 0 N--CA 1.428 -1.848 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.549 ' HA ' ' OE2' ' B' ' 138' ' ' GLU . 31.3 m -75.97 57.01 1.03 Allowed 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.1 mp -104.6 -33.3 8.57 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.556 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -66.04 -31.16 71.89 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.147 -1.388 . . . . 0.0 112.122 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 63.9 m -52.67 -33.54 47.73 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.417 0.687 . . . . 0.0 112.126 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -89.93 -38.09 13.92 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.972 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.512 ' SD ' HD11 ' B' ' 144' ' ' ILE . 9.7 tpt -60.71 -22.59 64.12 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.935 1.294 . . . . 0.0 109.587 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' B' ' 138' ' ' GLU . 51.3 mt-10 -54.78 -25.82 30.57 Favored 'General case' 0 C--O 1.194 -1.823 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.5 p -63.57 -59.82 4.13 Favored 'General case' 0 C--O 1.265 1.914 0 CA-C-N 119.54 1.064 . . . . 0.0 110.859 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' B' ' 141' ' ' MET . 9.0 pt -61.92 -35.41 67.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.736 0.779 . . . . 0.0 109.911 176.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.494 HG12 HG13 ' A' ' 26' ' ' ILE . 1.4 mp -67.91 -34.29 66.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.069 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 146' ' ' ARG . 21.6 ttt180 -65.18 -47.53 76.64 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 8.8 p -63.53 -33.91 76.64 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.987 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -80.68 -35.64 33.39 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -74.49 -23.59 58.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.023 0.374 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 59.7 ttp -57.33 -38.35 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 123.976 0.797 . . . . 0.0 109.605 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.7 t70 61.75 73.93 0.46 Allowed 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.795 1.238 . . . . 0.0 111.313 174.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.554 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.109 -178.797 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.553 0 N-CA-C 111.618 -0.593 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.5 m -117.03 129.27 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.724 0 CA-C-O 121.305 0.574 . . . . 0.0 110.221 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.488 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -78.41 134.87 37.34 Favored 'General case' 0 C--N 1.289 -2.042 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 175.086 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.545 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.5 ptpt -127.5 94.26 3.93 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.117 0.961 . . . . 0.0 111.196 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.64 0.13 10.83 Favored Glycine 0 CA--C 1.505 -0.536 0 CA-C-N 113.319 -1.764 . . . . 0.0 115.052 -173.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.545 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 68.1 p-90 -73.27 -9.13 58.38 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 117.392 0.596 . . . . 0.0 111.309 176.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.4 p-80 -57.62 -21.94 42.46 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 121.475 0.655 . . . . 0.0 112.099 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.8 -19.51 58.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.557 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -94.57 4.07 54.31 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.716 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -130.64 109.48 17.05 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 178.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 m -74.86 154.36 38.27 Favored 'General case' 0 N--CA 1.413 -2.279 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -52.06 -38.37 56.91 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.718 0.636 . . . . 0.0 110.261 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.684 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 13.9 t70 -60.41 -44.04 96.11 Favored 'General case' 0 C--O 1.179 -2.64 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.684 177.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.561 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.1 tm? -67.68 -51.58 47.98 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -171.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.561 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -60.38 -45.73 92.49 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.071 177.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.2 t -68.02 -22.25 64.98 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.953 0.882 . . . . 0.0 109.584 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.711 ' NE2' ' HA ' ' B' ' 119' ' ' SER . 2.1 t60 -71.61 -43.03 66.93 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.836 -1.074 . . . . 0.0 108.434 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -68.56 -33.6 74.37 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.735 176.013 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 15' ' ' ARG . 92.9 t -56.37 -48.14 80.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 O-C-N 123.773 0.671 . . . . 0.0 109.656 176.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.469 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 18.4 t-80 -66.2 -36.92 84.31 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.594 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -66.56 -35.24 79.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.89 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.8 mt -56.23 -46.04 79.7 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 175.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.9 t -57.32 -50.91 75.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 O-C-N 124.052 0.845 . . . . 0.0 111.165 173.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 68.6 mt-30 -60.57 -32.66 71.74 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.477 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -78.33 -46.18 20.75 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.959 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.599 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -70.28 -35.21 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.868 0.842 . . . . 0.0 109.621 -177.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 2.0 m-85 -127.01 90.78 48.57 Favored Pre-proline 0 N--CA 1.402 -2.844 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.89 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.503 ' HB2' ' HA2' ' B' ' 134' ' ' GLY . 23.8 Cg_endo -64.98 95.14 0.24 Allowed 'Trans proline' 0 N--CA 1.443 -1.484 0 C-N-CA 121.788 1.659 . . . . 0.0 108.207 174.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.449 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 9.9 t -68.87 136.36 89.91 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.798 -170.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.82 -25.36 10.7 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.213 2.608 . . . . 0.0 111.482 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -149.15 144.49 18.07 Favored Pre-proline 0 CA--C 1.49 -1.361 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.41 -13.45 33.0 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.286 1.991 . . . . 0.0 112.575 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.99 -9.33 58.75 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.0 -0.438 . . . . 0.0 111.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.449 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -79.76 -12.24 59.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.884 0.85 . . . . 0.0 109.034 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.458 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.3 mt -85.36 5.98 28.43 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.944 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.03 20.66 4.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.626 0.727 . . . . 0.0 109.736 177.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.61 ' O ' ' HB3' ' A' ' 40' ' ' MET . 23.4 t70 -81.65 175.94 10.06 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.85 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.574 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -71.17 -29.82 65.66 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.891 -0.506 . . . . 0.0 111.252 174.256 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -66.16 -23.45 66.47 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.945 0.879 . . . . 0.0 109.158 177.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -60.38 -36.78 78.88 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.951 176.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.8 pt-20 -61.46 -37.29 83.05 Favored 'General case' 0 C--O 1.2 -1.542 0 C-N-CA 118.444 -1.302 . . . . 0.0 109.672 -178.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -70.7 -43.04 69.84 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.727 0.811 . . . . 0.0 111.17 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.28 -43.82 73.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.641 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.645 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.3 p -73.3 -30.83 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.11 87.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 175.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.542 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.4 t80 -59.41 -46.78 87.74 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.546 175.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.39 -44.9 93.4 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.182 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -64.11 -42.8 96.74 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 122.938 0.495 . . . . 0.0 111.869 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 35.9 pttt -67.98 -40.13 83.18 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 -178.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 54' ' ' MET . 37.7 t -64.15 -50.47 76.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.933 178.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -56.19 -48.5 76.27 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.983 0.802 . . . . 0.0 109.24 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.86 96.28 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.079 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -60.25 -54.31 47.23 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.403 0.62 . . . . 0.0 110.034 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.519 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.3 ptp -67.76 -31.21 70.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.24 -35.72 80.13 Favored 'General case' 0 C--O 1.202 -1.432 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -20.57 37.3 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 121.296 -0.877 . . . . 0.0 111.748 177.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.3 t -80.65 -49.01 11.8 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.54 164.49 13.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -102.57 -5.01 24.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.988 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.2 m -157.81 154.17 27.64 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -63.6 -33.55 75.86 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.493 178.363 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -56.31 -47.49 78.59 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.44 0.638 . . . . 0.0 109.536 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.71 -45.03 80.05 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.753 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -41.01 98.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.636 ' CE1' HD13 ' B' ' 115' ' ' LEU . 8.5 t80 -63.19 -48.47 78.21 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.336 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m80 -67.25 -44.8 78.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -70.27 -30.57 67.63 Favored 'General case' 0 C--O 1.254 1.341 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.157 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.27 -41.09 67.12 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -58.3 -35.09 71.32 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.616 0.767 . . . . 0.0 111.57 176.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 32.3 mm-40 -70.08 -42.86 72.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.055 0.455 . . . . 0.0 111.122 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.54 -39.51 70.64 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.723 -179.327 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.627 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -67.29 -34.64 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.509 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 2.7 t80 -53.75 -50.88 65.03 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 124.856 1.263 . . . . 0.0 110.756 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.0 ptpt -66.73 -33.66 76.13 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.5 0.5 . . . . 0.0 110.77 -176.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.31 -45.35 98.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.6 mt-30 -59.71 -46.52 88.85 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.777 -176.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -79.03 -27.01 43.16 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -59.97 -46.08 90.6 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.704 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.2 pp -68.81 -40.65 79.43 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.127 178.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 47.3 mt-10 -55.57 -52.75 62.7 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 121.11 0.481 . . . . 0.0 110.818 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.3 pt-20 -67.1 -39.38 86.7 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.206 -176.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.91 -32.15 63.41 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.344 -178.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 2.0 ppt_? -74.39 -25.14 59.3 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.624 178.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -82.81 -40.54 20.25 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.0 t 78.07 90.39 0.06 Allowed 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.561 1.944 . . . . 0.0 108.314 -176.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.04 -17.06 59.82 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.13 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--N 1.312 -1.04 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.636 -178.091 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 N-CA-C 112.06 -0.416 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 69.7 m 64.12 84.84 0.14 Allowed 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.381 1.073 . . . . 0.0 113.257 -177.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.6 ttt 72.72 9.32 5.59 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.814 -1.539 . . . . 0.0 112.92 174.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.1 m -65.32 -42.88 92.51 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 35.7 m-70 -119.7 104.89 10.64 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 170.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -111.07 167.04 10.56 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -174.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 93.56 -47.99 2.33 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.521 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 28.8 p-10 -94.57 -12.17 28.05 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 124.335 1.054 . . . . 0.0 112.035 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -54.77 -37.09 65.56 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 124.268 0.98 . . . . 0.0 112.763 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.441 HG23 HD22 ' B' ' 111' ' ' LEU . 6.5 t -71.83 -32.89 68.0 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 121.054 0.454 . . . . 0.0 110.203 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.441 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -71.13 -41.81 70.03 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 17.4 mm-40 -67.98 -40.92 83.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.33 -178.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.84 -47.99 83.86 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.585 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 tt -55.54 -49.77 71.79 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.636 HD13 ' CE1' ' A' ' 65' ' ' TYR . 51.8 mt -55.89 -67.54 0.28 Allowed 'General case' 0 C--O 1.21 -1.025 0 O-C-N 124.287 0.992 . . . . 0.0 111.451 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 22.5 m -58.82 -38.33 78.42 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.694 -169.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.8 m -69.76 -51.77 31.15 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.047 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.54 -33.63 58.55 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.517 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.711 ' HA ' ' NE2' ' A' ' 17' ' ' HIS . 22.6 t -69.75 -54.88 11.65 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -175.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.7 mt -78.04 -30.34 49.84 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -173.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 34.5 t -76.44 -39.83 52.28 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -91.13 -57.25 2.86 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -171.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 75.1 m 68.77 127.74 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.44 0 O-C-N 123.627 0.58 . . . . 0.0 109.953 -167.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 60.82 20.46 10.62 Favored 'General case' 0 N--CA 1.508 2.47 0 C-N-CA 123.233 0.613 . . . . 0.0 111.428 -170.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' GLY . . . . . 0.52 ' H ' ' CE1' ' A' ' 17' ' ' HIS . . . -76.29 120.43 5.85 Favored Glycine 0 C--O 1.252 1.245 0 CA-C-N 115.762 -0.653 . . . . 0.0 113.038 -176.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 155.46 121.61 0.75 Allowed Glycine 0 N--CA 1.421 -2.322 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.34 -68.74 0.36 Allowed Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 39.7 m -93.3 155.42 17.42 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 106.86 -2.38 35.87 Favored Glycine 0 N--CA 1.438 -1.211 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -140.52 -121.02 1.76 Allowed Glycine 0 N--CA 1.438 -1.181 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 86.56 -64.34 3.98 Favored Glycine 0 C--N 1.31 -0.909 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.481 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.1 t -72.36 -11.6 60.76 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 121.418 0.627 . . . . 0.0 110.532 -178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -92.37 25.44 18.02 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 28' ' ' PRO . . . -145.96 -165.52 11.48 Favored Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 130.51 -149.68 19.06 Favored Glycine 0 N--CA 1.435 -1.39 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.3 m -79.9 68.44 6.0 Favored 'General case' 0 C--O 1.25 1.126 0 CA-C-O 121.966 0.888 . . . . 0.0 111.925 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 8.0 mp -105.07 -26.35 12.16 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.715 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.496 ' CD ' ' H ' ' B' ' 139' ' ' CYS . 0.0 OUTLIER -73.11 -61.84 1.67 Allowed 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.812 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 139' ' ' CYS . . . . . 0.496 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 6.5 p 26.89 -91.89 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.581 1.953 . . . . 0.0 115.564 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.39 -29.56 70.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.047 1.339 . . . . 0.0 110.982 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.704 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.0 ttt -64.71 -22.92 67.09 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 123.768 0.827 . . . . 0.0 110.966 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.584 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.9 mt-10 -54.48 -27.18 36.0 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -61.32 -51.0 70.66 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.013 0.435 . . . . 0.0 110.668 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -75.34 -24.35 17.38 Favored 'Isoleucine or valine' 0 C--O 1.249 1.049 0 CA-C-O 122.015 0.912 . . . . 0.0 110.764 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.599 ' CG2' HD11 ' A' ' 26' ' ' ILE . 16.1 mm -65.94 -42.24 91.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.776 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -60.37 -40.17 89.87 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 123.861 0.864 . . . . 0.0 108.906 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.2 m -56.12 -45.93 79.33 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 123.553 0.533 . . . . 0.0 110.017 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -71.02 -50.07 38.12 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.2 pp -71.69 -31.5 66.83 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -173.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.454 ' N ' HD12 ' B' ' 149' ' ' LEU . 16.4 tpt -87.61 -18.51 29.49 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.0 t70 64.51 79.66 0.25 Allowed 'General case' 0 C--O 1.241 0.618 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.225 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.416 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.919 -176.553 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.487 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.69 107.08 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.09 107.61 10.18 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-O 121.622 0.725 . . . . 0.0 109.429 176.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.0 ptpt -102.95 91.46 4.14 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 122.234 1.016 . . . . 0.0 110.994 176.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.9 -6.5 18.5 Favored Glycine 0 C--O 1.235 0.215 0 CA-C-N 114.098 -1.41 . . . . 0.0 115.679 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.462 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.1 p-90 -69.51 -11.27 60.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 117.601 0.701 . . . . 0.0 111.094 177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -60.23 -23.03 63.73 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.936 0.398 . . . . 0.0 111.471 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -79.88 -6.55 57.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.3 0.572 . . . . 0.0 110.512 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -101.05 9.56 42.01 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.788 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.717 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -126.19 111.28 26.05 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.265 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 177.703 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -73.19 150.16 42.33 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.7 tm0? -52.65 -37.99 59.54 Favored 'General case' 0 N--CA 1.441 -0.892 0 O-C-N 123.798 0.686 . . . . 0.0 110.075 176.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 12.4 m-20 -53.17 -44.75 68.11 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 175.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.596 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.57 -54.14 9.99 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 -170.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.1 ptm180 -59.79 -45.27 92.81 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 t -69.68 -25.56 63.95 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.484 0.659 . . . . 0.0 109.947 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.649 ' CE1' ' HA ' ' B' ' 119' ' ' SER . 19.5 t60 -65.92 -46.53 77.88 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.219 176.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -65.87 -34.5 78.29 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.259 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.4 t -55.35 -47.32 78.14 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 CA-C-O 121.33 0.586 . . . . 0.0 109.736 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.48 -37.37 82.8 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.145 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HZ3' ' CE1' ' A' ' 17' ' ' HIS . 12.6 mptt -64.54 -37.62 88.18 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.802 175.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 94.1 mt -56.67 -45.08 81.91 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.402 HG11 ' HE3' ' A' ' 40' ' ' MET . 55.6 t -60.4 -53.84 43.26 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 O-C-N 123.508 0.505 . . . . 0.0 110.491 173.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -53.22 -34.72 58.27 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.607 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -79.32 -46.15 18.25 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.675 HD11 HG23 ' B' ' 145' ' ' ILE . 5.5 tt -71.07 -33.25 50.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.311 0.577 . . . . 0.0 110.708 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.418 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 82.6 t80 -124.25 95.4 43.63 Favored Pre-proline 0 N--CA 1.409 -2.516 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.808 -176.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 29.2 Cg_endo -62.37 109.56 0.88 Allowed 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.478 2.118 . . . . 0.0 110.414 173.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.46 HG21 HD21 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -72.82 119.58 76.15 Favored Pre-proline 0 N--CA 1.397 -3.091 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.278 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.6 -15.19 11.11 Favored 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 122.398 2.065 . . . . 0.0 110.844 176.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.13 143.31 4.4 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.483 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.9 Cg_endo -59.88 -21.0 62.41 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.251 1.967 . . . . 0.0 113.346 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.13 -10.91 60.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.49 -0.756 . . . . 0.0 111.393 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.8 -13.93 59.97 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.682 0.753 . . . . 0.0 110.054 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 32' ' ' PRO . 7.7 mt -88.41 5.34 42.72 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.172 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -133.66 20.42 3.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.892 0.854 . . . . 0.0 109.537 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.649 ' O ' ' HB3' ' A' ' 40' ' ' MET . 13.7 t70 -80.58 172.91 13.15 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.865 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.609 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -72.06 -26.48 62.2 Favored 'General case' 0 C--N 1.309 -1.172 0 O-C-N 121.592 -0.693 . . . . 0.0 110.455 175.259 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -67.57 -25.8 65.97 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.649 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 3.0 tpp -59.92 -41.14 91.08 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.902 -1.044 . . . . 0.0 112.248 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 9.7 pt-20 -64.94 -27.9 69.15 Favored 'General case' 0 C--O 1.206 -1.229 0 C-N-CA 118.648 -1.221 . . . . 0.0 109.916 -177.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -74.03 -45.08 51.97 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.117 0.967 . . . . 0.0 110.337 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.99 -41.38 77.92 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.711 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.551 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.7 p -73.49 -30.47 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.29 -44.13 95.65 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 7.0 t80 -60.02 -51.09 71.14 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.203 172.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.21 -43.33 87.61 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.021 0.439 . . . . 0.0 111.223 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -66.25 -46.74 76.05 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 123.571 0.749 . . . . 0.0 111.838 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 12.5 pttp -63.79 -37.0 85.73 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.506 ' O ' ' HG2' ' A' ' 54' ' ' MET . 21.8 t -69.2 -53.15 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.295 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 55' ' ' TYR . 13.5 tm-20 -54.35 -50.5 67.3 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 124.198 0.936 . . . . 0.0 109.718 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.07 99.43 Favored Glycine 0 C--O 1.222 -0.651 0 O-C-N 123.576 0.547 . . . . 0.0 112.441 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -59.38 -52.2 66.64 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.227 0.537 . . . . 0.0 111.374 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.533 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.5 ptp -71.45 -27.51 63.31 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 40.9 t80 -64.26 -47.45 79.56 Favored 'General case' 0 C--O 1.206 -1.215 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 176.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -71.89 -25.71 62.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.26 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.5 t -80.84 -24.92 38.1 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.18 168.97 12.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -109.58 4.72 22.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.653 178.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.8 p -168.95 153.47 5.7 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.717 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -64.74 -33.83 76.9 Favored 'General case' 0 C--O 1.189 -2.109 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.812 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.77 -27.25 63.78 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.276 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.539 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 6.5 tp10 -75.32 -44.68 44.08 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 173.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -39.38 93.62 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.764 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.721 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 5.2 t80 -65.3 -46.99 78.18 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.069 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -56.4 -57.42 12.38 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 124.2 1.0 . . . . 0.0 111.697 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.9 pp -69.15 -30.32 68.53 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.52 -39.56 64.7 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.005 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.69 -38.8 82.57 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.091 176.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.69 -44.07 94.77 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -36.85 72.76 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 119.327 -0.949 . . . . 0.0 111.361 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.596 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.2 tt -69.98 -39.35 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.1 t80 -52.19 -53.29 45.1 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.073 1.349 . . . . 0.0 111.067 174.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -66.33 -34.01 77.02 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.007 -176.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.68 -42.84 93.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 O-C-N 123.426 0.454 . . . . 0.0 111.221 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.607 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 47.9 mt-30 -61.21 -48.77 79.99 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 121.414 0.625 . . . . 0.0 110.345 -178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.7 ptpt -74.93 -27.7 60.31 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.506 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -61.31 -47.78 84.4 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.41 ' HB3' ' HG3' ' B' ' 141' ' ' MET . 4.4 pp -69.78 -36.91 76.13 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.465 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.7 OUTLIER -61.72 -53.36 57.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.199 0.6 . . . . 0.0 110.96 179.426 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -73.01 -37.38 66.97 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -176.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HE2' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -72.8 -39.12 66.95 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.215 -175.92 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.584 ' HG2' HD22 ' B' ' 137' ' ' LEU . 22.8 tpt180 -76.8 -31.73 57.16 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -177.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -62.61 -34.68 77.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.9 t 84.75 88.73 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.027 2.131 . . . . 0.0 110.029 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -80.87 -23.92 38.7 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.531 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--O 1.253 1.261 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.009 173.574 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.129 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 36.3 m -87.98 82.6 7.19 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.156 0.503 . . . . 0.0 110.44 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.94 91.9 8.78 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-O 121.871 0.843 . . . . 0.0 109.018 -179.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 49.2 m -156.33 121.5 4.72 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 -77.61 131.38 37.77 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -67.73 -27.35 66.73 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 80.41 4.86 90.03 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.522 176.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 37.2 p30 -100.73 13.55 34.52 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.096 0.475 . . . . 0.0 110.697 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -58.32 -57.42 12.97 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.926 -1.034 . . . . 0.0 108.398 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 35.1 m -63.23 -43.23 98.64 Favored 'General case' 0 N--CA 1.422 -1.871 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.751 178.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.83 -57.81 11.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.614 0.571 . . . . 0.0 112.237 -178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 6.5 mm100 -69.19 -36.67 77.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.611 -173.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -64.71 -47.9 76.63 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.261 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.02 -47.59 85.21 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.439 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.721 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 18.3 mt -51.57 -66.41 0.39 Allowed 'General case' 0 C--O 1.214 -0.771 0 O-C-N 124.131 0.895 . . . . 0.0 111.738 177.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 15.0 t -62.56 -35.54 79.81 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -169.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -76.57 -44.35 35.04 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.304 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.477 ' O ' ' HB3' ' B' ' 122' ' ' HIS . 25.5 t70 -76.14 -27.79 57.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.077 0.465 . . . . 0.0 110.642 -175.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.649 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 19.8 t -76.82 -54.95 5.93 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.498 -0.481 . . . . 0.0 112.064 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.3 mt -77.79 -50.16 12.89 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 120.556 -0.458 . . . . 0.0 112.16 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.1 m -77.46 -28.07 52.28 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' HIS . . . . . 0.477 ' HB3' ' O ' ' B' ' 118' ' ' ASP . 6.7 t-160 -114.09 -8.01 13.04 Favored 'General case' 0 CA--C 1.562 1.423 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -170.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 39.7 t 69.07 -54.59 0.57 Allowed 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.751 1.22 . . . . 0.0 114.279 175.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -128.49 -59.55 1.15 Allowed 'General case' 0 CA--C 1.494 -1.195 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.42 -111.02 1.37 Allowed Glycine 0 C--O 1.242 0.647 0 O-C-N 124.643 1.215 . . . . 0.0 116.124 172.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -66.37 117.92 10.22 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.155 -0.523 . . . . 0.0 112.172 -175.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 169.23 50.69 0.03 OUTLIER Glycine 0 N--CA 1.411 -2.969 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.524 -178.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.0 t -116.97 -58.15 2.1 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 130.35 -169.34 21.26 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 120.367 -0.921 . . . . 0.0 111.433 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 75.67 -134.63 16.67 Favored Glycine 0 N--CA 1.434 -1.448 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 68.02 -123.68 18.65 Favored Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 16.3 m -98.55 -11.23 22.41 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 120.597 0.237 . . . . 0.0 110.819 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -142.89 88.3 0.18 Allowed Glycine 0 CA--C 1.496 -1.12 0 C-N-CA 120.288 -0.958 . . . . 0.0 111.758 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -140.24 76.89 0.32 Allowed Glycine 0 N--CA 1.434 -1.498 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.089 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -175.03 176.23 47.14 Favored Glycine 0 CA--C 1.487 -1.699 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.4 m -73.17 89.77 1.54 Allowed 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.709 0.766 . . . . 0.0 112.163 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.584 HD22 ' HG2' ' A' ' 83' ' ' ARG . 29.0 mt -105.48 -21.8 13.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 176.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 1.6 pm0 -75.77 -11.63 60.03 Favored 'General case' 0 C--O 1.199 -1.593 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.918 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 9.8 p -55.1 -34.28 63.53 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.94 -33.85 57.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.219 1.009 . . . . 0.0 110.369 175.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.429 ' O ' HG12 ' B' ' 145' ' ' ILE . 92.1 mmm -80.92 -30.81 35.29 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.444 -172.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.673 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 44.9 mt-10 -47.63 -29.85 3.26 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -173.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 35.0 t -59.3 -59.6 5.2 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 120.878 0.37 . . . . 0.0 110.299 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -70.54 -24.32 25.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.615 0.722 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 26' ' ' ILE . 13.3 mm -66.45 -49.95 71.19 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.604 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 19.1 mtp180 -66.25 -34.89 79.04 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 120.48 0.181 . . . . 0.0 110.902 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 t -57.22 -43.02 82.43 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 123.935 0.772 . . . . 0.0 109.111 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -77.1 -54.92 5.92 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.188 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.616 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.3 pp -65.17 -26.64 68.25 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 -172.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.4 ' N ' HD12 ' B' ' 149' ' ' LEU . 15.6 tpt -79.36 -23.23 43.5 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.379 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.84 110.75 23.15 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.533 -175.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.464 ' HB3' ' HD2' ' A' ' 49' ' ' LYS . . . . . . . . 0 CA--C 1.509 -0.624 0 C-N-CA 126.85 2.06 . . . . 0.0 107.054 175.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.841 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 44.5 t -100.48 131.7 47.54 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -89.48 110.45 21.28 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 90.5 mttt -99.72 119.55 38.3 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.946 -177.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -50.56 -29.8 18.6 Favored Glycine 0 C--O 1.239 0.456 0 O-C-N 124.292 0.995 . . . . 0.0 115.107 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.419 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 69.3 p-90 -67.48 -7.29 24.41 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -55.84 -30.36 61.33 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.024 0.44 . . . . 0.0 111.354 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -75.84 -10.46 59.45 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.046 0.45 . . . . 0.0 111.173 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -106.78 11.98 29.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.205 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.508 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.3 p -128.38 112.2 26.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 121.753 0.787 . . . . 0.0 109.685 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -74.62 150.07 39.78 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.963 -175.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -59.24 -41.98 90.01 Favored 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -65.02 -29.4 70.31 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.384 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -74.41 -52.34 12.37 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 -177.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.3 ptm180 -65.87 -42.29 90.56 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.57 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -69.68 -25.83 64.08 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CD2' ' HB3' ' B' ' 119' ' ' SER . 73.0 t60 -66.73 -45.31 79.07 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 121.41 0.624 . . . . 0.0 109.599 175.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.704 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -62.7 -36.8 84.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.232 177.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -60.78 -48.75 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.318 0.647 . . . . 0.0 109.65 173.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.487 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 33.0 t-80 -55.12 -45.18 75.54 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.32 0.648 . . . . 0.0 110.767 177.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -66.39 -37.87 86.22 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.871 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.98 -43.16 86.39 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 18.6 t -54.55 -49.64 64.91 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 C-N-CA 123.964 0.906 . . . . 0.0 111.0 173.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.95 -15.93 61.1 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.655 -0.818 . . . . 0.0 113.112 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.08 -45.67 16.14 Favored 'General case' 0 C--O 1.208 -1.107 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.46 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.563 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.8 tt -70.53 -30.47 42.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 122.417 1.103 . . . . 0.0 109.885 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.486 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 85.3 t80 -134.85 83.37 41.13 Favored Pre-proline 0 N--CA 1.399 -3.007 0 CA-C-N 114.192 -1.367 . . . . 0.0 107.872 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.78 94.0 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.381 2.054 . . . . 0.0 108.284 170.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 t -63.78 126.99 91.0 Favored Pre-proline 0 N--CA 1.414 -2.263 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.862 -169.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -72.75 -26.4 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.78 2.32 . . . . 0.0 111.298 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.4 142.47 14.62 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.88 -25.14 34.11 Favored 'Trans proline' 0 CA--C 1.554 1.485 0 C-N-CA 122.562 2.175 . . . . 0.0 114.559 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.64 -10.81 59.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.258 -0.902 . . . . 0.0 111.82 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.55 59.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.577 0.703 . . . . 0.0 109.914 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.438 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -87.5 0.38 55.64 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.089 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.86 34.37 3.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 122.002 0.906 . . . . 0.0 110.681 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.662 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.0 t70 -95.32 177.25 5.91 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.454 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.662 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.01 -25.67 62.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 121.723 -0.611 . . . . 0.0 109.778 176.909 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.5 ttm180 -66.24 -24.57 66.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.556 175.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.583 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 6.1 tpp -60.57 -43.74 96.95 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.54 -0.754 . . . . 0.0 112.38 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HA ' HG12 ' A' ' 44' ' ' VAL . 11.3 pt-20 -67.56 -26.43 66.3 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 118.603 -1.239 . . . . 0.0 110.297 -177.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -73.1 -44.89 59.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.744 177.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 77.6 mt -69.78 -41.03 75.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.578 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 41' ' ' GLU . 3.6 p -71.77 -28.18 29.98 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.668 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.2 87.04 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.273 0.559 . . . . 0.0 109.545 175.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.0 t80 -60.95 -45.87 92.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.294 174.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.84 97.92 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.418 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -62.56 -45.62 92.11 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.571 0.749 . . . . 0.0 112.225 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 12.7 pttp -63.91 -37.39 87.21 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.354 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 51.0 t -72.22 -47.71 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.321 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.74 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.12 -45.24 91.41 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.004 0.922 . . . . 0.0 109.863 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.88 -42.15 99.71 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.937 177.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.97 -54.11 50.59 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.376 0.27 . . . . 0.0 111.32 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.462 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -67.23 -30.98 71.03 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.401 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -59.31 -49.59 77.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -77.34 -21.67 53.01 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.324 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -80.97 -35.9 31.54 Favored 'General case' 0 CA--C 1.553 1.075 0 CA-C-O 120.609 0.242 . . . . 0.0 111.498 -178.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.58 167.84 16.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.133 0.492 . . . . 0.0 111.499 -178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -121.83 15.1 10.9 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.639 0.733 . . . . 0.0 110.503 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.5 m -156.0 148.92 24.2 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.508 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -68.04 -39.75 83.0 Favored 'General case' 0 C--O 1.191 -1.997 0 CA-C-O 121.034 0.445 . . . . 0.0 111.542 -179.737 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -67.71 -32.87 73.81 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 123.627 0.771 . . . . 0.0 108.982 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.56 -48.05 70.89 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.617 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -41.28 98.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.565 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -49.26 77.91 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.819 1.248 . . . . 0.0 109.764 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 32.6 m170 -64.1 -49.03 73.85 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.419 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.2 pp -69.62 -30.45 68.18 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.75 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.704 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -74.56 -35.99 63.08 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.906 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.524 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.62 -31.79 73.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.1 mm-40 -71.57 -43.2 66.75 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.035 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -71.41 -36.29 71.29 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.331 -179.085 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.592 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.4 tt -67.23 -39.78 83.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' B' ' 108' ' ' ASN . 26.5 t80 -55.24 -54.66 40.61 Favored 'General case' 0 C--O 1.262 1.716 0 C-N-CA 124.491 1.116 . . . . 0.0 111.291 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 18.1 ptpt -64.42 -34.67 78.73 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.229 -177.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.14 -40.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 O-C-N 123.395 0.434 . . . . 0.0 111.187 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.1 mt-30 -65.76 -52.49 50.57 Favored 'General case' 0 CA--C 1.489 -1.375 0 CA-C-O 121.504 0.669 . . . . 0.0 110.471 -177.11 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -72.18 -27.93 62.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.31 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -61.62 -51.97 66.3 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 123.635 0.584 . . . . 0.0 109.631 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -62.39 -40.31 96.07 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.489 -178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.412 ' N ' HD12 ' A' ' 79' ' ' LEU . 3.4 tm-20 -62.62 -49.74 73.98 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 123.366 0.666 . . . . 0.0 110.468 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -75.01 -35.49 61.97 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.78 -29.03 60.99 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.572 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -64.12 -46.25 85.02 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 173.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -62.69 -37.17 85.4 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.548 175.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . 0.251 49.7 m 86.86 69.57 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 125.891 1.676 . . . . 0.0 113.851 175.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -113.34 -17.43 12.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.45 170.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.117 1.367 . . . . 0.0 107.446 173.904 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.584 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -58.79 -50.32 74.37 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.304 0.642 . . . . 0.0 110.876 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 86.4 mtp -95.9 18.85 12.43 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.0 t -84.28 -16.93 41.36 Favored 'General case' 0 C--O 1.244 0.802 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -81.0 161.24 24.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -104.36 101.61 11.31 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.47 55.14 4.39 Favored Glycine 0 C--O 1.219 -0.802 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.548 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 31.2 p30 -98.54 2.54 47.61 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 123.671 0.789 . . . . 0.0 111.745 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.73 -46.15 58.99 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -171.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.431 HG23 HD22 ' B' ' 111' ' ' LEU . 5.1 t -65.3 -40.13 93.41 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.579 -0.448 . . . . 0.0 111.613 -177.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.431 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -73.35 -46.48 48.92 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.226 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -59.22 -42.24 90.53 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 120.967 0.413 . . . . 0.0 110.596 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.48 -43.59 89.75 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.851 176.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -55.96 -49.44 73.53 Favored 'General case' 0 C--O 1.264 1.823 0 CA-C-O 121.42 0.628 . . . . 0.0 109.868 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.423 HD23 ' O ' ' B' ' 111' ' ' LEU . 4.1 mm? -53.51 -54.61 34.79 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.302 176.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 33.6 m -60.85 -43.16 98.7 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.273 0.983 . . . . 0.0 110.481 -176.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 40.2 t -58.45 -49.55 76.93 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.414 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -77.13 -52.48 9.2 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 117.679 -1.608 . . . . 0.0 112.828 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.498 ' HB3' ' CD2' ' A' ' 17' ' ' HIS . 77.6 p -77.01 -54.23 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -171.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.2 mt -81.98 -23.46 36.03 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -171.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 41.0 m -68.93 -53.79 19.01 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.508 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -112.74 -71.3 0.76 Allowed 'General case' 0 C--O 1.237 0.425 0 C-N-CA 118.49 -1.284 . . . . 0.0 109.668 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 74.0 p 166.63 97.03 0.0 OUTLIER 'General case' 0 C--O 1.248 1.004 0 C-N-CA 125.18 1.392 . . . . 0.0 107.491 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 20.3 t70 65.8 174.95 0.22 Allowed 'General case' 0 CA--C 1.555 1.16 0 O-C-N 123.683 0.614 . . . . 0.0 110.35 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -147.1 83.67 0.18 Allowed Glycine 0 N--CA 1.414 -2.788 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -68.71 91.73 0.27 Allowed Glycine 0 N--CA 1.436 -1.305 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 178.48 -96.98 0.1 Allowed Glycine 0 N--CA 1.422 -2.282 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.6 t -168.28 150.19 5.21 Favored 'General case' 0 N--CA 1.428 -1.526 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 154.44 104.88 0.24 Allowed Glycine 0 N--CA 1.425 -2.066 0 N-CA-C 109.039 -1.624 . . . . 0.0 109.039 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 156.66 -45.24 0.51 Allowed Glycine 0 C--N 1.289 -2.07 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -175.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.04 104.56 0.19 Allowed Glycine 0 N--CA 1.436 -1.334 0 N-CA-C 111.389 -0.684 . . . . 0.0 111.389 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.0 t -139.24 144.94 38.65 Favored 'General case' 0 N--CA 1.416 -2.167 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 111.51 41.97 1.09 Allowed Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.938 -0.648 . . . . 0.0 111.815 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -107.63 -147.88 13.81 Favored Glycine 0 N--CA 1.435 -1.404 0 N-CA-C 110.733 -0.947 . . . . 0.0 110.733 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 153.12 -42.57 0.65 Allowed Glycine 0 C--N 1.3 -1.448 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.6 m -139.24 8.04 2.44 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 122.369 -0.489 . . . . 0.0 111.885 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 6.5 mp -87.82 -32.43 19.05 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.671 0.748 . . . . 0.0 109.29 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.535 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 1.4 mp0 -62.63 -49.46 75.11 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.624 -1.171 . . . . 0.0 108.591 179.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 8.0 t -73.11 -15.8 61.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.36 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -76.48 -38.83 54.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.462 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.0 ttt -80.98 -14.58 57.83 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.722 0.809 . . . . 0.0 110.386 177.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.635 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.282 21.0 mt-10 -49.57 -28.03 5.16 Favored 'General case' 0 C--O 1.187 -2.229 0 N-CA-C 116.574 2.064 . . . . 0.0 116.574 -176.415 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 p -54.79 -60.04 3.91 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 119.167 0.894 . . . . 0.0 111.274 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.429 HD11 ' HG3' ' B' ' 141' ' ' MET . 22.1 pt -68.99 -25.47 30.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.753 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.635 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 17.4 mm -70.87 -40.52 76.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.196 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.747 177.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 24.5 mmm180 -60.83 -47.8 84.7 Favored 'General case' 0 CA--C 1.498 -1.019 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.4 p -60.11 -38.25 82.42 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 119.564 -0.854 . . . . 0.0 111.747 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.599 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 55.2 mm-40 -66.17 -57.56 7.36 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 175.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.479 HD23 HG22 ' B' ' 145' ' ' ILE . 4.3 pp -61.48 -23.75 66.1 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -173.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.407 ' HG3' HD12 ' B' ' 149' ' ' LEU . 70.0 mtm -86.47 -6.54 58.88 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.796 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -130.04 109.19 10.66 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 121.954 0.883 . . . . 0.0 112.968 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.618 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 174.621 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.455 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.407 HG13 ' HG2' ' A' ' 56' ' ' GLU . 5.2 m -131.26 108.01 14.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.019 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.44 70.55 1.98 Allowed 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 123.159 1.457 . . . . 0.0 107.849 172.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 77.5 mttt -128.55 118.91 23.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.611 -1.631 . . . . 0.0 107.904 -175.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -50.31 -30.44 18.31 Favored Glycine 0 CA--C 1.524 0.647 0 O-C-N 124.119 0.887 . . . . 0.0 114.678 -174.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.404 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 65.8 p-90 -71.31 -5.68 34.16 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.574 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 20.8 p-80 -70.51 -11.89 61.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.91 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 13.1 pt-20 -90.71 -6.83 53.96 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.989 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.8 m80 -95.08 5.88 50.62 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.408 0.683 . . . . 0.0 110.044 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.4 p -133.07 121.46 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 m -77.91 149.88 34.15 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -61.62 -36.1 79.79 Favored 'General case' 0 C--O 1.205 -1.242 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 9.6 m-20 -66.02 -29.26 69.6 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.2 tm? -73.22 -51.55 17.29 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -177.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.518 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.3 ptm180 -65.14 -43.07 93.05 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.106 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.43 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 38.9 t -64.68 -28.83 69.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 121.464 0.649 . . . . 0.0 109.288 178.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -67.23 -43.86 80.93 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.637 176.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.501 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -63.46 -37.45 87.33 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.313 176.833 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 15' ' ' ARG . 89.7 t -55.03 -47.05 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.423 0.689 . . . . 0.0 109.595 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.462 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 13.2 t-80 -63.31 -37.05 85.75 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.313 178.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.66 -32.65 66.0 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 118.891 -1.124 . . . . 0.0 111.783 176.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.4 mt -57.06 -43.68 82.27 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 173.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 23.4 t -57.63 -46.79 86.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.1 172.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 34.6 mt-30 -69.96 -31.16 68.73 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.529 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -73.36 -45.9 52.31 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.441 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.3 tt -70.85 -33.74 53.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.393 0.616 . . . . 0.0 110.781 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.436 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 68.5 t80 -127.02 81.74 69.35 Favored Pre-proline 0 N--CA 1.418 -2.074 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.717 -174.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.438 ' HG3' ' HB2' ' B' ' 137' ' ' LEU . 10.7 Cg_endo -53.57 120.15 7.36 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.346 2.697 . . . . 0.0 109.358 169.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.5 112.72 4.54 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 -170.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.38 -12.42 9.12 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 121.82 1.68 . . . . 0.0 108.498 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.539 ' HA ' ' O ' ' B' ' 131' ' ' GLY . 6.3 t70 -176.83 137.56 0.43 Allowed Pre-proline 0 CA--C 1.496 -1.126 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.93 -22.19 73.66 Favored 'Trans proline' 0 N--CA 1.45 -1.061 0 C-N-CA 121.989 1.793 . . . . 0.0 112.158 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.88 -3.47 57.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.914 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.07 -10.72 59.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.107 0.956 . . . . 0.0 108.453 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.84 5.4 25.28 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.627 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.6 16.92 3.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.638 0.733 . . . . 0.0 110.351 175.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.0 t70 -83.19 179.1 7.82 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.806 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -69.86 -26.76 64.36 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.51 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 12.1 ttm180 -68.03 -21.01 65.04 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 9.0 tpp -63.44 -44.01 95.77 Favored 'General case' 0 C--O 1.206 -1.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.315 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.1 pt-20 -62.62 -30.02 71.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 119.347 -0.941 . . . . 0.0 109.73 -177.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.429 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.9 t30 -71.41 -47.65 54.69 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 124.57 1.148 . . . . 0.0 110.309 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 82.5 mt -69.11 -41.8 76.93 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.391 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.509 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -73.32 -27.82 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.78 77.12 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.581 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 3.1 t80 -56.23 -42.41 77.25 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.108 0.563 . . . . 0.0 109.889 173.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.84 -42.52 85.61 Favored 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.083 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -64.44 -42.48 95.97 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.508 0.323 . . . . 0.0 111.638 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.581 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 5.1 ptmt -63.02 -44.81 94.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.244 176.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 52.7 t -63.66 -50.04 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.602 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -56.28 -46.7 79.61 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 109.201 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.559 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . -59.53 -44.06 97.07 Favored Glycine 0 N--CA 1.443 -0.847 0 O-C-N 123.945 0.778 . . . . 0.0 112.335 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.69 -54.36 47.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 122.787 0.435 . . . . 0.0 110.838 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.436 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -68.22 -31.97 71.85 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.129 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.574 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 83.9 t80 -61.74 -46.35 90.01 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 123.703 0.801 . . . . 0.0 109.848 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 52' ' ' GLY . 35.5 mt-10 -80.1 -22.75 41.84 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.016 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.404 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 46.4 m -76.35 -30.61 57.69 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.86 167.27 15.31 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -115.04 7.43 15.5 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.47 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.446 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 70.0 m -159.97 153.66 22.71 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.546 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -71.16 -36.63 72.08 Favored 'General case' 0 C--O 1.179 -2.617 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -177.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 5.2 p-10 -70.07 -27.29 64.5 Favored 'General case' 0 C--N 1.29 -1.982 0 C-N-CA 124.17 0.988 . . . . 0.0 108.792 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.46 -46.75 46.42 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.19 99.28 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.501 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 1.2 t80 -55.0 -49.5 71.36 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.317 1.447 . . . . 0.0 109.591 174.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -64.49 -53.97 39.72 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.169 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.436 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -69.03 -30.02 68.3 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.94 -176.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.0 OUTLIER -70.4 -39.53 74.42 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.582 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.02 -34.43 77.56 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 123.567 0.542 . . . . 0.0 110.096 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -71.08 -38.71 72.42 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.636 176.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -76.24 -35.46 58.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 118.976 -1.09 . . . . 0.0 111.236 -179.269 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.616 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.3 tt -67.75 -36.91 77.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.564 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.5 t80 -53.23 -53.01 56.95 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.133 1.373 . . . . 0.0 111.263 174.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.3 ptpt -67.84 -31.97 72.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.784 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.48 -43.38 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 O-C-N 123.402 0.439 . . . . 0.0 110.09 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.2 mt-30 -62.9 -54.28 41.04 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.093 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.4 ptpt -68.54 -27.87 66.48 Favored 'General case' 0 N--CA 1.398 -3.063 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.431 -176.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.7 tm-20 -62.88 -52.57 62.58 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 177.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.516 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -64.31 -38.06 89.69 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.66 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.88 -41.37 87.34 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 123.489 0.493 . . . . 0.0 111.686 178.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.2 pt-20 -72.7 -42.65 63.97 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -178.071 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.469 ' HE2' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.86 -34.91 64.67 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 83' ' ' ARG . 2.2 mmp_? -72.43 -49.89 30.28 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -69.52 -35.57 75.61 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.3 m 72.78 72.8 0.14 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.6 -1.636 . . . . 0.0 109.888 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -93.76 -10.75 33.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.58 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.254 1.337 0 CA-C-N 114.235 -1.348 . . . . 0.0 109.919 -178.59 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.807 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 38.6 t -112.15 142.72 44.27 Favored 'General case' 0 N--CA 1.418 -2.04 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 65.0 mtt -105.67 15.57 26.69 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.0 m -84.28 92.56 8.02 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.315 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -94.26 102.85 14.88 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -150.91 173.78 13.88 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -177.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.02 53.67 9.06 Favored Glycine 0 CA--C 1.498 -1.008 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 39.1 p-10 -118.1 17.4 14.05 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.125 -1.038 . . . . 0.0 109.711 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.94 -50.17 58.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.8 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -63.76 -43.9 95.05 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 122.735 0.414 . . . . 0.0 110.34 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 3.2 mm? -63.56 -52.45 61.03 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.209 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' B' ' 112' ' ' GLN . 13.0 mt-30 -68.79 -44.32 73.86 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.229 -178.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.56 -41.11 98.43 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.353 0.408 . . . . 0.0 110.977 -178.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.49 -45.87 87.81 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 49.1 mt -57.73 -58.55 7.84 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.102 177.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.7 m -55.32 -38.95 69.37 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.307 0.575 . . . . 0.0 111.167 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' B' ' 121' ' ' SER . 28.2 p -77.63 -43.8 30.32 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.566 -175.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' B' ' 122' ' ' HIS . 20.3 t0 -74.64 -37.62 62.73 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.624 -176.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' B' ' 123' ' ' SER . 68.3 p -76.78 -53.72 7.56 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -177.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 92.9 mt -82.08 -54.08 5.58 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.952 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' B' ' 117' ' ' SER . 13.7 m -72.56 -47.8 45.25 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 122' ' ' HIS . . . . . 0.508 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 47.7 m170 -81.64 -49.38 10.56 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 110.823 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' B' ' 119' ' ' SER . 50.4 m 74.86 -63.01 0.44 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.391 1.476 . . . . 0.0 112.528 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -111.69 148.62 33.04 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 116.789 -0.187 . . . . 0.0 110.808 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 155.55 73.93 0.01 OUTLIER Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -132.52 150.84 19.77 Favored Glycine 0 C--N 1.304 -1.243 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.252 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 83.37 -10.28 59.28 Favored Glycine 0 C--N 1.314 -0.668 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.788 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 22.6 t -133.64 131.11 39.19 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 171.06 -155.77 25.23 Favored Glycine 0 N--CA 1.43 -1.728 0 N-CA-C 109.394 -1.483 . . . . 0.0 109.394 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -102.83 154.51 18.28 Favored Glycine 0 C--N 1.307 -1.036 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.912 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' GLY . . . . . 0.539 ' O ' ' HA ' ' A' ' 31' ' ' ASP . . . 136.77 108.99 0.92 Allowed Glycine 0 N--CA 1.429 -1.78 0 N-CA-C 111.721 -0.552 . . . . 0.0 111.721 178.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 12.7 p -126.65 11.25 7.28 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 122.01 0.91 . . . . 0.0 109.905 175.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 110.17 -171.44 14.84 Favored Glycine 0 N--CA 1.424 -2.161 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.63 -10.4 45.35 Favored Glycine 0 C--N 1.314 -0.66 0 CA-C-N 117.372 0.586 . . . . 0.0 112.662 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -148.71 36.59 1.06 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 108.912 -1.675 . . . . 0.0 108.912 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.4 ' HB2' ' OE1' ' B' ' 138' ' ' GLU . 6.4 p -94.68 92.81 7.19 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 122.104 0.954 . . . . 0.0 109.904 -179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.438 ' HB2' ' HG3' ' A' ' 28' ' ' PRO . 9.2 mp -84.04 -15.05 48.96 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.679 -1.146 . . . . 0.0 112.433 -177.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.436 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -55.81 -37.81 69.14 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.033 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -70.68 75.59 0.59 Allowed 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 121.499 0.666 . . . . 0.0 111.108 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 61.7 t0 164.27 -59.6 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 128.007 2.523 . . . . 0.0 105.26 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.668 ' SD ' HD11 ' B' ' 144' ' ' ILE . 14.0 tpt -58.05 -37.09 73.73 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 113.964 -1.471 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 24.6 tt0 -53.97 -27.15 29.55 Favored 'General case' 0 CA--C 1.567 1.627 0 C-N-CA 124.793 1.237 . . . . 0.0 112.298 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -63.27 -59.41 4.76 Favored 'General case' 0 C--O 1.276 2.46 0 CA-C-O 121.282 0.563 . . . . 0.0 110.756 178.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.668 HD11 ' SD ' ' B' ' 141' ' ' MET . 46.7 pt -62.95 -28.53 45.23 Favored 'Isoleucine or valine' 0 C--N 1.354 0.773 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 10.6 mm -65.27 -43.69 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.839 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.1 177.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.432 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 74.9 mtt85 -63.55 -40.94 98.3 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 119.97 -0.692 . . . . 0.0 111.689 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.8 p -66.6 -26.21 66.98 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.383 176.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -80.59 -49.82 10.8 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.864 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.7 pp -67.39 -29.22 68.68 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.67 -0.644 . . . . 0.0 111.446 -176.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 39.2 tpp -67.36 -29.26 68.75 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.17 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -96.92 116.25 28.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.555 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -179.959 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.189 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.1 t -84.13 111.12 19.57 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -79.3 118.76 21.51 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.955 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.609 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 46.0 mttp -118.73 99.64 6.9 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -22.88 36.11 Favored Glycine 0 C--O 1.247 0.915 0 O-C-N 123.968 0.792 . . . . 0.0 114.134 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.609 ' NE1' ' HB3' ' A' ' 4' ' ' LYS . 66.5 p-90 -64.17 -10.06 20.71 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.8 p-80 -60.24 -27.71 67.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.992 0.425 . . . . 0.0 111.24 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.59 -5.45 59.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.105 0.478 . . . . 0.0 111.062 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -96.52 -24.75 15.92 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.554 0.692 . . . . 0.0 110.153 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.551 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -96.71 124.36 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.661 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.749 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 m -86.08 151.62 23.54 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.061 -176.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -42.21 78.0 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 122.996 0.519 . . . . 0.0 110.291 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -61.45 -31.74 71.7 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.602 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.64 -52.32 15.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 -174.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.454 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -62.58 -45.99 90.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.96 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 m -67.13 -23.48 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.033 0.444 . . . . 0.0 110.561 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 25.4 t60 -68.59 -45.18 72.71 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.602 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -62.19 -38.69 90.07 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.674 177.539 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.462 ' HA ' HD12 ' A' ' 22' ' ' LEU . 94.2 t -54.72 -47.77 73.27 Favored 'Isoleucine or valine' 0 C--O 1.256 1.4 0 C-N-CA 123.138 0.575 . . . . 0.0 110.235 176.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -58.64 -44.75 90.16 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.132 178.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -71.13 -29.75 65.64 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.025 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.1 mt -56.99 -45.17 83.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 175.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.567 HG11 ' HE1' ' A' ' 40' ' ' MET . 15.3 t -61.95 -51.44 72.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 O-C-N 123.799 0.687 . . . . 0.0 111.436 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.521 ' HB3' ' H ' ' B' ' 129' ' ' GLY . 23.5 mm-40 -63.97 -25.81 68.3 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.341 -175.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.518 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.34 -45.52 16.04 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.587 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.539 HD11 HG21 ' B' ' 145' ' ' ILE . 3.2 tt -70.57 -31.0 44.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.523 0.677 . . . . 0.0 109.391 -177.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.447 ' CD2' ' HG2' ' B' ' 138' ' ' GLU . 1.5 m-85 -127.93 90.43 47.73 Favored Pre-proline 0 N--CA 1.407 -2.616 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.086 -176.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 28.6 Cg_endo -65.09 104.31 0.58 Allowed 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 121.848 1.698 . . . . 0.0 108.156 171.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.43 117.65 17.85 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 118.203 2.668 . . . . 0.0 118.203 -168.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -80.05 -19.52 9.39 Favored 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 122.468 2.112 . . . . 0.0 110.251 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -156.94 144.65 14.02 Favored Pre-proline 0 CA--C 1.483 -1.601 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.95 -12.47 26.1 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.145 1.23 . . . . 0.0 110.167 174.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.04 -13.75 60.9 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.069 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -21.66 63.38 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.67 0.748 . . . . 0.0 109.601 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.41 2.11 54.92 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.346 -178.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -136.09 19.01 3.21 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.529 0.681 . . . . 0.0 110.222 173.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.554 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 18.1 t70 -88.61 -179.37 6.02 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.554 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.88 -28.25 64.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 174.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.6 -23.14 66.76 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.567 ' HE1' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -62.66 -40.61 97.6 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 179.097 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -65.56 -36.97 85.34 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.526 -178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.48 -43.67 93.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.504 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.51 -43.35 63.7 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.168 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.52 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 p -73.47 -34.35 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.812 -179.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.13 95.15 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 175.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -61.54 -48.63 80.14 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.787 173.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.29 96.78 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 96.8 mttt -67.07 -45.04 78.54 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.259 0.624 . . . . 0.0 111.764 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 16.0 pttp -64.69 -40.24 95.06 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 54' ' ' MET . 20.7 t -64.91 -51.43 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.229 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.267 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -54.33 -51.31 65.12 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.932 0.893 . . . . 0.0 109.967 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -36.56 93.59 Favored Glycine 0 CA--C 1.52 0.385 0 CA-C-N 116.295 -0.411 . . . . 0.0 113.131 -179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.86 -54.32 48.39 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.793 0.806 . . . . 0.0 108.829 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.621 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.4 ptp -74.31 -28.43 61.16 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.519 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.4 ' HA ' ' CD1' ' A' ' 64' ' ' TYR . 72.5 t80 -59.23 -52.43 65.71 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 174.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -71.82 -27.86 63.2 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.123 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -71.72 -22.63 61.6 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 122.599 0.36 . . . . 0.0 111.638 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.02 168.31 10.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.446 0.641 . . . . 0.0 112.3 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -121.13 13.85 11.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.469 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -156.71 151.48 25.85 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.551 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.8 -36.5 67.59 Favored 'General case' 0 C--O 1.179 -2.614 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.554 177.527 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.25 -30.52 70.98 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 12.9 tp10 -71.75 -48.08 49.3 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.625 176.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.4 ' CD1' ' HA ' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -61.9 -39.4 91.87 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.602 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.522 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.5 OUTLIER -58.79 -48.23 82.01 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 124.604 1.161 . . . . 0.0 109.131 173.24 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -64.49 -55.62 19.52 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 122.921 0.488 . . . . 0.0 110.375 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.621 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -64.84 -30.45 71.45 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.38 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.55 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -76.1 -38.52 56.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.041 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.08 -36.25 82.96 Favored 'General case' 0 C--O 1.19 -2.069 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.71 -44.22 90.95 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.122 0.969 . . . . 0.0 112.407 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -72.87 -35.31 67.15 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.973 -178.581 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.631 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.5 tt -72.02 -35.67 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.585 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.16 -52.52 60.87 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 125.799 1.64 . . . . 0.0 110.818 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -67.29 -35.1 78.79 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.544 0.528 . . . . 0.0 110.584 -177.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.75 -42.18 95.07 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.6 mt-30 -63.59 -49.6 72.71 Favored 'General case' 0 CA--C 1.492 -1.278 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.1 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.607 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.4 ptpt -73.46 -29.4 62.51 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.939 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.2 tp10 -58.98 -52.45 65.7 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.69 -39.06 84.44 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.942 -178.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.5 OUTLIER -63.39 -52.98 59.36 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.246 -179.382 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.0 pt-20 -69.74 -34.15 73.45 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -33.92 77.02 Favored 'General case' 0 C--N 1.347 0.481 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.088 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -77.35 -51.66 10.47 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.15 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -70.48 -60.38 2.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -171.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m -166.1 95.09 0.57 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -172.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HG3' ' HG ' ' A' ' 87' ' ' LEU . 30.4 ptt180 -178.34 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 124.246 1.018 . . . . 0.0 109.108 169.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.44 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 78.0 mt . . . . . 0 C--O 1.259 1.568 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.651 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.5 m -137.3 152.09 49.38 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.104 -0.548 . . . . 0.0 110.473 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 14.7 tpt -130.42 80.77 1.97 Allowed 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 5.1 p -90.49 -36.02 14.76 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.712 -1.131 . . . . 0.0 112.06 -174.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -95.74 97.43 9.69 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -126.44 94.98 4.22 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-O 122.016 0.912 . . . . 0.0 109.682 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -108.15 -12.31 22.19 Favored Glycine 0 N--CA 1.437 -1.274 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -79.28 14.32 1.57 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -51.02 -57.72 7.89 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 124.909 1.284 . . . . 0.0 111.227 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.2 m -57.01 -43.72 82.07 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.936 -178.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 2.9 mm? -69.61 -52.22 27.99 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.505 -175.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -66.16 -43.98 85.41 Favored 'General case' 0 CA--C 1.503 -0.846 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.199 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.99 -43.96 97.74 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 123.68 0.612 . . . . 0.0 110.814 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.36 -45.02 92.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.119 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 66.5 mt -57.03 -62.95 1.39 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.522 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 12.2 t -60.49 -32.77 71.75 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 120.909 0.385 . . . . 0.0 111.722 -174.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 36.9 m -71.74 -49.14 41.83 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.322 0.582 . . . . 0.0 110.329 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.635 ' O ' ' HB3' ' B' ' 122' ' ' HIS . 23.3 t70 -76.06 -30.22 58.29 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.536 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.467 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 22.8 t -78.31 -55.2 5.43 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.92 -47.9 12.16 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -171.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.7 m -74.7 -38.64 62.31 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.059 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 122' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' B' ' 118' ' ' ASP . 48.8 t60 -93.0 -7.81 44.8 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -175.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 47.4 t 74.23 -68.25 0.22 Allowed 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.496 1.118 . . . . 0.0 112.06 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -169.31 162.9 10.65 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 -175.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 167.34 -149.6 15.15 Favored Glycine 0 N--CA 1.414 -2.784 0 C-N-CA 119.789 -1.195 . . . . 0.0 112.253 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -113.78 45.63 1.29 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 111.556 -0.618 . . . . 0.0 111.556 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -66.09 95.11 0.23 Allowed Glycine 0 CA--C 1.508 -0.404 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.0 m -89.34 147.53 24.03 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 120.801 0.334 . . . . 0.0 110.203 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' GLY . . . . . 0.521 ' H ' ' HB3' ' A' ' 24' ' ' GLN . . . -115.91 158.92 14.12 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 110.26 -78.3 0.24 Allowed Glycine 0 N--CA 1.416 -2.635 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 178.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 83.7 -61.61 4.72 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 108.875 -1.69 . . . . 0.0 108.875 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.9 p -82.74 82.84 7.91 Favored 'General case' 0 N--CA 1.407 -2.588 0 CA-C-O 121.661 0.743 . . . . 0.0 109.563 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -137.09 136.4 8.28 Favored Glycine 0 N--CA 1.424 -2.148 0 N-CA-C 109.314 -1.515 . . . . 0.0 109.314 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 144.35 -55.46 0.56 Allowed Glycine 0 C--N 1.293 -1.86 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -83.11 80.92 1.78 Allowed Glycine 0 CA--C 1.493 -1.301 0 N-CA-C 107.171 -2.372 . . . . 0.0 107.171 172.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.526 ' HA ' ' OE2' ' B' ' 138' ' ' GLU . 73.4 m -33.35 111.39 0.1 Allowed 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -170.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 4.0 mp -96.93 -21.42 17.46 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.044 -1.889 . . . . 0.0 106.15 173.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.526 ' OE2' ' HA ' ' B' ' 136' ' ' SER . 1.3 mp0 -60.72 -41.93 96.24 Favored 'General case' 0 C--O 1.184 -2.368 0 CA-C-N 114.099 -1.41 . . . . 0.0 110.771 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 66.4 m -49.24 -48.4 45.73 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -174.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.14 -32.91 67.34 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.775 0.798 . . . . 0.0 109.559 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.484 ' SD ' HD11 ' B' ' 144' ' ' ILE . 11.1 tpt -70.6 -38.67 74.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.833 -176.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.563 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 48.4 mt-10 -53.22 -27.24 20.94 Favored 'General case' 0 C--O 1.202 -1.411 0 C-N-CA 124.823 1.249 . . . . 0.0 113.716 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.9 m -65.07 -57.33 8.9 Favored 'General case' 0 C--O 1.263 1.795 0 CA-C-O 121.274 0.559 . . . . 0.0 110.184 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.484 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.9 pp -72.55 -25.49 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.711 0.767 . . . . 0.0 110.563 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.563 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.6 mm -71.14 -33.5 51.37 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.807 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.459 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -62.53 -44.72 95.66 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -58.61 -50.74 72.72 Favored 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.123 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.01 -47.05 87.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.773 1.229 . . . . 0.0 112.956 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.572 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.2 pp -71.0 -30.89 67.25 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.85 -0.531 . . . . 0.0 111.546 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 51.7 tpp -76.09 -53.25 8.6 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.502 -178.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -112.54 -75.01 0.61 Allowed 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.202 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 179.896 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.391 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -85.76 141.16 14.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 122.247 -0.561 . . . . 0.0 110.024 177.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.518 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -97.08 119.13 35.0 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.011 -178.546 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -113.9 137.01 52.26 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -50.53 -31.4 21.71 Favored Glycine 0 N--CA 1.465 0.62 0 O-C-N 124.157 0.911 . . . . 0.0 115.309 -173.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.95 -5.04 27.9 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -63.29 -17.27 62.34 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.25 0.547 . . . . 0.0 111.048 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.29 -22.2 61.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.04 0.448 . . . . 0.0 110.393 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -96.45 3.06 53.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -134.07 117.23 24.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.692 0.758 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -97.35 168.38 10.44 Favored 'General case' 0 N--CA 1.402 -2.828 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -56.75 -45.82 81.8 Favored 'General case' 0 C--O 1.198 -1.641 0 O-C-N 124.659 1.225 . . . . 0.0 109.667 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 5.5 p-10 -55.49 -37.46 67.85 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD12 HG23 ' A' ' 10' ' ' VAL . 3.3 tm? -73.4 -48.54 33.11 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.7 ptm180 -69.2 -41.68 76.81 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.447 -177.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -71.78 -23.63 61.61 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.581 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 16.7 t60 -72.34 -39.76 67.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.504 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -67.3 -35.58 79.75 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.847 175.426 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.7 t -58.92 -40.33 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 172.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -62.55 -44.13 97.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.859 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.6 mptp? -68.89 -35.93 77.47 Favored 'General case' 0 CA--C 1.503 -0.837 0 C-N-CA 120.204 -0.598 . . . . 0.0 112.321 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 19' ' ' VAL . 66.1 mt -54.84 -43.37 72.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.2 t -62.29 -50.44 79.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.55 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -66.01 -22.34 66.45 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.903 -176.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.84 -46.23 14.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 177.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.556 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.6 tt -70.88 -29.33 36.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.604 0 CA-C-O 122.294 1.045 . . . . 0.0 108.891 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.551 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 87.9 t80 -129.05 89.31 48.95 Favored Pre-proline 0 N--CA 1.391 -3.385 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.858 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.44 ' HG2' ' HG3' ' B' ' 138' ' ' GLU . 10.2 Cg_endo -52.89 129.51 33.3 Favored 'Trans proline' 0 N--CA 1.444 -1.395 0 C-N-CA 121.954 1.769 . . . . 0.0 108.446 170.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' HD21 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -86.23 117.54 68.86 Favored Pre-proline 0 N--CA 1.408 -2.547 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -169.079 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -78.43 -23.93 8.18 Favored 'Trans proline' 0 N--CA 1.443 -1.479 0 N-CA-C 108.995 -1.194 . . . . 0.0 108.995 172.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -170.25 145.13 2.23 Favored Pre-proline 0 N--CA 1.44 -0.936 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.423 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.51 -20.39 40.94 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.832 2.355 . . . . 0.0 113.596 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -77.67 -11.52 59.88 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.064 -1.022 . . . . 0.0 112.555 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.17 -6.43 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.74 0.781 . . . . 0.0 109.129 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.2 mt -89.92 7.2 38.52 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.716 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 17.9 ptpt -129.88 15.41 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.93 0.871 . . . . 0.0 109.187 175.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 40' ' ' MET . 27.7 t70 -81.75 176.38 9.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.748 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.82 -27.47 63.9 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.034 0.445 . . . . 0.0 110.718 178.503 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.603 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.1 ttp180 -72.98 -17.1 61.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.632 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 4.4 tpp -63.08 -45.48 91.93 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.138 176.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.06 -31.16 72.24 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.711 -175.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -67.56 -49.18 64.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.375 1.47 . . . . 0.0 110.021 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 76.9 mt -67.78 -44.62 76.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.458 -177.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.4 p -71.81 -30.32 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.346 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.167 -177.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.18 -48.69 80.66 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.559 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.2 t80 -59.06 -46.64 87.74 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.468 174.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.16 95.23 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.583 0.23 . . . . 0.0 110.915 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -63.68 -46.28 86.25 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.367 0.667 . . . . 0.0 112.277 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -61.82 -41.35 97.67 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.41 -51.68 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.331 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -57.62 -48.61 78.96 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.848 0.859 . . . . 0.0 109.723 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.93 -40.25 95.1 Favored Glycine 0 N--CA 1.451 -0.356 0 O-C-N 123.762 0.664 . . . . 0.0 112.619 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.57 -54.87 40.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.351 0.26 . . . . 0.0 111.146 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.492 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.3 OUTLIER -68.68 -29.68 68.19 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -62.42 -48.49 79.45 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -79.43 -16.63 55.83 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.492 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 38.8 m -84.43 -23.32 30.04 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.23 165.74 12.96 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -107.99 2.73 23.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.584 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 80.5 p -162.75 159.61 24.39 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.436 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.33 -35.36 68.58 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.973 -176.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.58 -35.31 78.76 Favored 'General case' 0 C--O 1.209 -1.06 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -65.03 -47.05 78.78 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.717 174.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -43.37 98.48 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -57.95 -48.74 79.07 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 124.728 1.211 . . . . 0.0 109.512 175.5 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -64.05 -49.91 70.49 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.291 0.369 . . . . 0.0 111.575 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -70.13 -30.39 67.56 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.932 -177.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.504 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -71.43 -42.21 68.53 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.494 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.31 -35.0 74.58 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 123.363 0.665 . . . . 0.0 110.338 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 5.0 mm-40 -66.82 -48.38 69.13 Favored 'General case' 0 C--O 1.26 1.632 0 C-N-CA 123.444 0.698 . . . . 0.0 112.243 175.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.88 -37.61 70.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.904 -0.718 . . . . 0.0 110.914 -178.045 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.669 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -66.23 -37.75 80.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 6.8 t80 -52.59 -54.05 38.28 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 125.232 1.413 . . . . 0.0 111.193 174.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.2 ptpt -65.46 -32.41 74.0 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.097 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.6 mp -65.41 -43.59 94.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 CA-C-O 120.624 0.25 . . . . 0.0 110.508 177.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 63.7 mt-30 -63.29 -53.83 46.74 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.102 -175.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -70.07 -28.78 65.71 Favored 'General case' 0 N--CA 1.395 -3.214 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.023 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.7 tp10 -59.77 -51.7 68.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.662 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -63.31 -44.42 95.0 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.979 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 7.5 pt-20 -72.05 -40.24 68.51 Favored 'General case' 0 C--O 1.195 -1.808 0 C-N-CA 119.024 -1.071 . . . . 0.0 113.158 -177.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.2 pt-20 -72.8 -32.97 65.94 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 119.497 1.044 . . . . 0.0 111.681 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.446 ' HA ' ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -69.28 -29.43 67.32 Favored 'General case' 0 CA--C 1.493 -1.245 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.401 177.02 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -77.73 -45.43 24.74 Favored 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.135 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.5 ttm-85 -82.91 -59.5 2.47 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 115.384 1.624 . . . . 0.0 115.384 -167.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.3 p -158.33 22.4 0.24 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -165.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.446 ' HD2' ' HA ' ' A' ' 82' ' ' LYS . 7.2 ptm180 -78.42 -21.95 48.47 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 118.215 -1.394 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 C--O 1.251 1.144 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.575 177.63 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 55.1 m -97.35 -7.66 31.39 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 117.315 0.557 . . . . 0.0 111.315 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.4 ptm -72.33 157.8 36.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 30.9 m -78.27 78.45 4.75 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.487 0.66 . . . . 0.0 110.216 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 36.3 p-80 -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.896 0.855 . . . . 0.0 108.783 177.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.41 ' HA ' ' OH ' ' A' ' 73' ' ' TYR . 96.0 m-85 -81.03 104.81 11.78 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.207 -1.361 . . . . 0.0 108.614 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -105.2 31.03 8.98 Favored Glycine 0 C--N 1.297 -1.627 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -70.08 -13.5 62.24 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -174.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.461 ' CD ' ' H ' ' B' ' 109' ' ' GLN . 10.4 mp0 -67.17 -44.19 80.35 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.5 m -63.26 -38.38 90.92 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.518 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.91 -45.22 75.0 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-O 121.13 0.49 . . . . 0.0 111.168 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -72.85 -28.67 62.67 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.513 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.31 -48.37 82.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 109.251 175.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -57.1 -50.0 74.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.423 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.64 -54.19 48.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.083 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.4 t -65.09 -28.18 69.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.668 0.27 . . . . 0.0 110.913 -176.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.5 m -73.42 -41.59 63.09 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.075 0.464 . . . . 0.0 110.389 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB3' ' NE2' ' A' ' 17' ' ' HIS . 23.3 m-20 -75.97 -58.74 3.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.979 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.581 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 15.8 t -77.88 -55.36 5.38 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -172.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 93.8 mt -74.28 -25.91 59.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -169.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -76.66 -19.0 58.24 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.819 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' HIS . . . . . 0.485 ' CG ' ' HA3' ' B' ' 126' ' ' GLY . 55.1 m80 -115.26 -63.19 1.49 Allowed 'General case' 0 C--O 1.243 0.746 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 36.6 t 71.67 114.63 0.05 Allowed 'General case' 0 C--O 1.257 1.454 0 C-N-CA 125.621 1.568 . . . . 0.0 110.978 -172.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.433 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . 20.3 t70 70.52 -70.58 0.15 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.422 1.489 . . . . 0.0 112.15 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -95.43 90.36 1.24 Allowed Glycine 0 N--CA 1.434 -1.498 0 N-CA-C 111.436 -0.665 . . . . 0.0 111.436 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.485 ' HA3' ' CG ' ' B' ' 122' ' ' HIS . . . 162.93 156.68 8.67 Favored Glycine 0 N--CA 1.431 -1.674 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.61 74.89 0.88 Allowed Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 12.8 t -79.19 -168.63 1.55 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 123.122 0.569 . . . . 0.0 110.295 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -80.43 60.42 4.54 Favored Glycine 0 C--O 1.238 0.347 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -86.47 111.47 3.63 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -173.99 147.05 9.08 Favored Glycine 0 N--CA 1.428 -1.854 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 63.2 m -150.75 106.87 3.44 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.153 0.501 . . . . 0.0 110.714 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 166.97 -177.36 41.69 Favored Glycine 0 N--CA 1.433 -1.502 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.88 -172.45 33.93 Favored Glycine 0 C--N 1.304 -1.235 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.149 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.37 -50.79 0.88 Allowed Glycine 0 C--N 1.299 -1.521 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.8 p -131.23 12.06 5.04 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.74 -0.73 . . . . 0.0 110.353 178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.4 mp -95.69 -56.76 2.57 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.826 -176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.551 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -64.61 -42.16 95.73 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.711 178.69 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.21 -37.68 69.98 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 123.865 0.728 . . . . 0.0 110.538 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -82.99 -35.07 26.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.362 0.601 . . . . 0.0 110.22 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.662 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 11.9 tpt -64.19 -27.33 68.99 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.652 1.181 . . . . 0.0 109.774 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -47.77 -26.47 1.61 Allowed 'General case' 0 C--O 1.193 -1.9 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.7 m -59.41 -60.6 3.6 Favored 'General case' 0 C--O 1.272 2.251 0 CA-C-N 118.756 0.707 . . . . 0.0 111.503 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.606 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.4 pp -73.63 -25.9 21.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 122.246 1.022 . . . . 0.0 110.711 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 7.3 mm -68.72 -33.71 61.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -66.6 -42.77 86.36 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 m -59.78 -26.96 66.14 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.421 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.55 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 22.8 mm-40 -80.64 -62.71 1.59 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.98 -35.2 74.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -169.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.4 tpt -71.87 -55.97 6.57 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 120.439 -0.504 . . . . 0.0 111.313 -175.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -146.78 110.34 4.88 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.239 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 178.399 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.445 0 CA-C-O 120.256 -0.191 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.402 HG22 ' OE2' ' A' ' 56' ' ' GLU . 34.0 m -89.33 171.31 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 117.108 0.454 . . . . 0.0 109.871 178.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.417 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -129.85 96.31 4.19 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.213 1.006 . . . . 0.0 111.103 179.227 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -91.02 138.15 31.82 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.95 -29.14 8.03 Favored Glycine 0 N--CA 1.478 1.443 0 N-CA-C 115.87 1.108 . . . . 0.0 115.87 -172.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -72.75 -6.08 42.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -62.11 -18.25 60.21 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.28 0.562 . . . . 0.0 111.534 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -90.15 0.2 57.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.468 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.5 m-70 -113.05 4.39 16.65 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.541 0.686 . . . . 0.0 110.454 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HD12 ' A' ' 14' ' ' LEU . 7.7 p -129.15 125.68 62.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.1 m -96.54 154.05 17.5 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.093 -175.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 tm0? -53.77 -40.62 66.4 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 123.185 0.594 . . . . 0.0 111.105 177.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.42 -33.89 74.46 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.545 HD12 HG23 ' A' ' 10' ' ' VAL . 2.8 tm? -74.4 -51.05 16.13 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -175.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB2' ' OE2' ' A' ' 51' ' ' GLU . 8.1 ptm180 -63.21 -43.05 99.23 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.785 -1.098 . . . . 0.0 112.041 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.437 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 35.6 t -67.8 -26.15 65.93 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.65 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.659 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 20.6 t60 -71.95 -38.21 69.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.075 177.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -64.45 -35.57 81.36 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.251 175.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.1 t -56.06 -49.52 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-O 121.529 0.68 . . . . 0.0 109.654 175.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -57.37 -45.15 84.73 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.798 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' CD2' ' B' ' 115' ' ' LEU . 20.2 mttp -67.51 -35.55 79.33 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.351 177.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 19' ' ' VAL . 82.3 mt -56.74 -43.92 81.2 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.629 0.372 . . . . 0.0 110.037 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HA ' HG22 ' A' ' 26' ' ' ILE . 85.5 t -63.6 -48.38 87.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.321 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -63.49 -25.21 68.15 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.538 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.01 -46.27 16.91 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.292 176.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.487 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.5 tt -70.44 -35.78 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 109.997 -177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.44 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 53.5 t80 -121.82 99.28 44.6 Favored Pre-proline 0 N--CA 1.397 -3.078 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.512 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 43.1 Cg_endo -65.11 98.08 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.967 1.778 . . . . 0.0 108.603 171.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -71.2 132.9 85.85 Favored Pre-proline 0 N--CA 1.426 -1.673 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.321 -174.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -72.63 -37.15 4.25 Favored 'Trans proline' 0 C--O 1.217 -0.561 0 C-N-CA 122.524 2.149 . . . . 0.0 111.53 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -140.73 153.46 67.87 Favored Pre-proline 0 CA--C 1.494 -1.175 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.85 -15.54 49.57 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.338 2.025 . . . . 0.0 111.72 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.47 -18.94 54.14 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.314 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.92 -6.11 53.29 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.603 0.716 . . . . 0.0 110.019 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.8 mt -90.76 -0.48 57.72 Favored 'General case' 0 C--O 1.21 -1.018 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.342 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -132.74 20.6 4.21 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.202 1.001 . . . . 0.0 109.213 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.594 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 16.5 t70 -88.5 170.22 11.08 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.407 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.6 -25.45 68.1 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 122.997 0.519 . . . . 0.0 112.029 -179.341 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 38.8 ttp180 -75.14 -19.14 60.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 109.723 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.574 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 7.9 tpp -61.46 -46.56 89.52 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.792 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -58.85 -29.29 66.84 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 123.263 0.352 . . . . 0.0 110.922 -177.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.453 ' HB2' ' H ' ' B' ' 132' ' ' SER . 6.4 t30 -71.58 -51.74 21.82 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.68 0.752 . . . . 0.0 110.213 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.9 -45.75 84.59 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.103 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.0 p -73.26 -28.59 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.123 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.89 -49.74 76.63 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -56.51 -46.01 80.75 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.893 174.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.88 99.8 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 120.552 0.215 . . . . 0.0 111.187 -178.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.9 mttm -64.48 -48.1 76.47 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.134 0.574 . . . . 0.0 111.313 178.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.1 pttp -63.58 -40.63 97.44 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-O 121.282 0.563 . . . . 0.0 109.6 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.416 ' O ' ' HG2' ' A' ' 54' ' ' MET . 9.1 t -64.93 -47.86 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.619 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.9 tm-20 -54.16 -49.1 70.03 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 123.744 0.818 . . . . 0.0 109.766 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.22 -43.06 98.84 Favored Glycine 0 C--O 1.236 0.247 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.491 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.54 -52.42 65.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.97 0.508 . . . . 0.0 110.344 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.506 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 1.2 ptp -71.65 -27.92 63.4 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.572 0.952 . . . . 0.0 113.572 179.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -63.1 -49.48 74.29 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' OE2' HG22 ' A' ' 2' ' ' VAL . 31.6 mt-10 -78.38 -17.4 56.51 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.369 0.604 . . . . 0.0 111.864 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.506 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 24.7 m -79.97 -19.4 47.99 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.46 166.34 11.57 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -109.87 4.31 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.909 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -161.55 160.79 29.43 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.415 ' CD ' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -70.16 -36.15 74.49 Favored 'General case' 0 C--O 1.191 -2.017 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.584 -179.74 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.75 -31.59 70.74 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.55 -42.56 64.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.359 -0.213 . . . . 0.0 111.016 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -43.21 96.17 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -56.27 -48.95 75.55 Favored 'General case' 0 C--O 1.197 -1.668 0 C-N-CA 124.924 1.29 . . . . 0.0 108.857 173.74 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -59.37 -55.55 33.25 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 123.492 0.717 . . . . 0.0 111.09 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.462 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.8 pp -71.17 -29.89 65.76 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.314 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.455 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.66 -39.43 70.31 Favored 'General case' 0 C--N 1.344 0.329 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 176.799 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.547 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.28 -35.84 81.69 Favored 'General case' 0 C--O 1.202 -1.415 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.655 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.4 mm-40 -67.42 -42.87 82.51 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.075 0.55 . . . . 0.0 111.668 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -71.1 -36.55 72.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.654 -179.089 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.667 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -70.49 -38.78 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.506 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 19.2 t80 -52.81 -54.3 36.15 Favored 'General case' 0 C--O 1.265 1.883 0 C-N-CA 124.972 1.309 . . . . 0.0 110.997 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -65.26 -38.4 90.19 Favored 'General case' 0 C--O 1.189 -2.081 0 O-C-N 123.823 0.702 . . . . 0.0 110.117 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.15 -40.79 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.465 0.478 . . . . 0.0 110.712 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 60.5 mt-30 -61.98 -54.95 34.59 Favored 'General case' 0 CA--C 1.496 -1.115 0 O-C-N 123.87 0.731 . . . . 0.0 110.596 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -73.21 -27.12 61.44 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.815 -177.111 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.3 tt0 -67.9 -43.57 78.98 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HA ' ' HG3' ' A' ' 82' ' ' LYS . 4.3 pp -69.57 -33.66 73.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.291 178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 41.5 mt-10 -63.89 -52.91 57.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.184 176.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.84 -38.8 92.43 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.671 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.563 ' HB2' ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -67.5 -28.72 68.08 Favored 'General case' 0 CA--C 1.505 -0.779 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.239 178.823 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.413 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 20.9 tpt180 -76.87 -35.14 57.66 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.843 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 6.5 ptp180 -99.7 -43.14 6.57 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 31.0 p -124.57 13.31 8.71 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -171.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HD2' ' HB2' ' A' ' 82' ' ' LYS . 9.3 ptm180 -89.28 -28.28 20.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 116.985 -1.886 . . . . 0.0 110.564 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 C--O 1.245 0.841 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 176.351 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.191 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 23.0 t -101.5 16.67 24.93 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 24.3 mmt -86.63 81.16 8.34 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.594 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.3 t -78.04 -38.5 44.41 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 -112.85 143.08 44.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 73.3 t80 74.73 8.33 4.29 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 122.47 1.128 . . . . 0.0 109.639 -175.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -92.24 36.21 3.75 Favored Glycine 0 N--CA 1.44 -1.049 0 O-C-N 121.366 -0.834 . . . . 0.0 113.468 -175.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 36.3 p30 -77.36 -8.91 58.44 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-O 121.452 0.644 . . . . 0.0 111.68 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -50.95 -49.14 60.51 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 125.582 1.553 . . . . 0.0 112.456 177.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.403 HG23 HD22 ' B' ' 111' ' ' LEU . 8.7 t -75.37 -33.38 61.04 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 120.814 0.34 . . . . 0.0 110.329 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 4.2 mm? -64.35 -50.59 67.14 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.955 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -69.94 -33.77 72.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.739 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -62.33 -46.84 86.88 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.789 -0.764 . . . . 0.0 110.424 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 66.4 tp -57.9 -41.8 83.37 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.778 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.545 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 50.6 mt -61.94 -66.14 0.58 Allowed 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.229 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.3 m -52.54 -36.01 54.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.457 0.703 . . . . 0.0 112.24 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 54.5 p -76.72 -55.31 5.61 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.975 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.86 -24.34 52.63 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -174.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.659 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 42.4 p -65.92 -55.29 17.64 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -76.98 -25.15 52.4 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -176.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.5 p -76.13 -51.33 12.42 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.005 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -79.32 -45.42 19.67 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 -178.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 22.9 m 63.91 -172.46 0.17 Allowed 'General case' 0 C--O 1.247 0.924 0 C-N-CA 123.689 0.795 . . . . 0.0 110.561 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 66.45 154.29 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 176.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -161.03 -85.47 0.06 OUTLIER Glycine 0 N--CA 1.428 -1.84 0 N-CA-C 107.896 -2.082 . . . . 0.0 107.896 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.66 -135.76 15.83 Favored Glycine 0 N--CA 1.434 -1.436 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 174.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 98.14 158.53 30.14 Favored Glycine 0 N--CA 1.432 -1.631 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.653 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 1.3 p -87.03 -160.96 0.63 Allowed 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 124.971 1.309 . . . . 0.0 110.739 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -159.77 112.61 0.53 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.072 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -163.12 -152.38 6.8 Favored Glycine 0 C--N 1.319 -0.37 0 C-N-CA 121.071 -0.585 . . . . 0.0 111.919 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -144.0 114.7 0.83 Allowed Glycine 0 C--O 1.24 0.519 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' SER . . . . . 0.453 ' H ' ' HB2' ' A' ' 42' ' ' ASN . 47.6 m -162.51 105.11 1.1 Allowed 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.36 1.064 . . . . 0.0 108.682 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -98.77 174.89 28.4 Favored Glycine 0 C--O 1.244 0.769 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.226 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 116.69 68.61 0.4 Allowed Glycine 0 N--CA 1.435 -1.4 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -77.52 -125.63 0.31 Allowed Glycine 0 N--CA 1.446 -0.696 0 O-C-N 123.557 0.21 . . . . 0.0 113.575 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 43.0 m -156.56 -46.22 0.07 Allowed 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 24.1 tp -105.96 -39.67 5.93 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.35 0.595 . . . . 0.0 111.319 -173.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -54.4 -52.62 61.13 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 125.693 1.597 . . . . 0.0 113.088 -176.673 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 52.2 m 54.31 -95.32 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -80.8 -9.86 59.78 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.265 -0.897 . . . . 0.0 111.236 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.647 ' O ' HG12 ' B' ' 145' ' ' ILE . 16.0 tpt -77.45 -27.27 52.08 Favored 'General case' 0 C--O 1.204 -1.313 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 171.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' B' ' 138' ' ' GLU . 7.1 tt0 -71.59 -25.99 62.41 Favored 'General case' 0 C--O 1.193 -1.88 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.678 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.5 m -55.47 -51.83 65.67 Favored 'General case' 0 C--O 1.266 1.971 0 CA-C-O 121.134 0.492 . . . . 0.0 110.329 175.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.531 HD11 ' SD ' ' B' ' 141' ' ' MET . 43.3 pt -67.0 -32.87 59.96 Favored 'Isoleucine or valine' 0 C--N 1.342 0.249 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.647 HG12 ' O ' ' B' ' 141' ' ' MET . 22.4 mm -65.68 -33.47 63.86 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.82 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.198 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.406 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 58.0 ttp180 -65.27 -43.02 92.58 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.129 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 49.3 m -62.41 -37.45 85.85 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.767 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.628 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 12.7 mm-40 -72.82 -43.85 62.18 Favored 'General case' 0 C--O 1.199 -1.575 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 178.375 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.406 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -68.13 -33.92 75.38 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.362 0.528 . . . . 0.0 110.673 -177.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 21.7 mmt -77.68 -22.48 50.49 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 121.046 0.45 . . . . 0.0 109.867 174.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.91 1.16 3.93 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.638 1.575 . . . . 0.0 111.684 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.8 0 C-N-CA 124.524 1.13 . . . . 0.0 108.178 179.474 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.912 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 m -72.86 142.52 14.99 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.551 ' H ' ' HD2' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -90.63 97.64 11.3 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 122.273 1.035 . . . . 0.0 109.945 -175.869 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 mttp -86.58 124.64 33.1 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 113.652 -1.613 . . . . 0.0 107.187 -174.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -51.64 -23.35 9.86 Favored Glycine 0 N--CA 1.478 1.459 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 p-90 -70.48 -12.16 61.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -64.77 -19.47 65.83 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.049 0.452 . . . . 0.0 111.859 -177.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -90.23 -8.54 50.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.438 0.637 . . . . 0.0 110.117 179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -96.89 10.74 38.17 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.89 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.494 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.8 p -138.5 115.01 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.008 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.0 m -91.96 154.45 18.81 Favored 'General case' 0 C--N 1.289 -2.039 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -49.82 -41.62 45.29 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 123.527 0.731 . . . . 0.0 111.047 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.52 -41.15 72.73 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.143 0.577 . . . . 0.0 111.535 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.419 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -74.09 -50.47 19.4 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -173.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 19' ' ' VAL . 9.1 ptm180 -65.53 -38.41 89.57 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.026 -177.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -74.01 -22.67 59.5 Favored 'General case' 0 N--CA 1.423 -1.801 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.452 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 26.0 t60 -74.15 -35.26 64.05 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 174.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.629 HD23 HD21 ' A' ' 68' ' ' LEU . 3.1 mp -63.9 -38.27 90.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.3 t -60.89 -46.57 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.465 0.706 . . . . 0.0 109.421 172.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.452 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 69.0 t60 -53.72 -48.48 69.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.438 176.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -65.21 -39.32 92.64 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.906 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 19' ' ' VAL . 49.9 mt -54.65 -48.05 72.79 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.216 0.322 . . . . 0.0 110.417 174.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.25 -48.99 85.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.018 0 O-C-N 123.842 0.714 . . . . 0.0 111.481 174.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.476 ' HB3' ' HB3' ' B' ' 132' ' ' SER . 60.1 mt-30 -71.3 -20.58 62.18 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -176.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.499 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.36 -46.2 15.02 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.05 176.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.571 HD11 ' CG2' ' B' ' 145' ' ' ILE . 1.7 tt -70.47 -35.15 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-O 122.269 1.033 . . . . 0.0 108.724 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' HA ' ' HB3' ' B' ' 138' ' ' GLU . 4.9 m-85 -127.87 89.14 51.42 Favored Pre-proline 0 N--CA 1.398 -3.035 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.946 -178.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.41 84.16 0.37 Allowed 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.954 1.769 . . . . 0.0 107.663 171.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 t -52.14 134.58 40.34 Favored Pre-proline 0 N--CA 1.424 -1.735 0 CA-C-N 113.965 -1.47 . . . . 0.0 113.396 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.49 -22.35 21.42 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.203 2.602 . . . . 0.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -157.38 141.57 11.69 Favored Pre-proline 0 CA--C 1.511 -0.555 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -178.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -56.92 -18.09 26.49 Favored 'Trans proline' 0 CA--C 1.549 1.262 0 C-N-CA 122.921 2.414 . . . . 0.0 114.346 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.77 -15.17 57.98 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 121.493 -0.754 . . . . 0.0 112.06 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.39 -9.6 58.86 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.879 0.847 . . . . 0.0 109.463 176.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.8 mt -89.4 1.56 55.66 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 114.704 -1.134 . . . . 0.0 110.494 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -134.89 12.6 3.65 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.389 1.09 . . . . 0.0 109.497 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.599 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 31.7 t70 -87.36 177.65 7.06 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.985 -1.461 . . . . 0.0 110.001 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.599 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -18.08 62.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.435 0.636 . . . . 0.0 110.668 178.993 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -74.37 -28.02 60.92 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -64.48 -43.5 93.96 Favored 'General case' 0 C--O 1.193 -1.913 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.479 -176.394 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HA ' HG22 ' A' ' 44' ' ' VAL . 7.1 pt-20 -61.58 -29.6 70.13 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.088 0.47 . . . . 0.0 110.966 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -74.61 -44.2 51.82 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.698 176.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.74 -42.38 81.95 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.711 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.483 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 28.4 m -69.83 -35.77 66.54 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.124 0 CA-C-O 119.08 -0.486 . . . . 0.0 110.125 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.97 85.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.41 0.624 . . . . 0.0 109.691 176.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.524 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.69 -47.42 86.36 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.826 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.4 93.97 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.017 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 67.6 mttm -66.3 -44.33 83.77 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.292 0.637 . . . . 0.0 111.443 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.9 pttp -63.46 -41.11 98.62 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.599 0.714 . . . . 0.0 109.602 -179.048 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.414 HG11 ' HE2' ' A' ' 71' ' ' LYS . 38.0 t -66.29 -51.98 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.022 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.409 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.4 tm-20 -55.76 -47.79 76.4 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.271 1.029 . . . . 0.0 109.846 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.44 -38.62 96.06 Favored Glycine 0 N--CA 1.443 -0.857 0 O-C-N 123.665 0.603 . . . . 0.0 112.717 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -62.03 -51.95 65.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.452 0.644 . . . . 0.0 110.883 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.2 ptp -72.15 -27.29 62.5 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.929 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -62.54 -53.74 50.2 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.61 -26.45 65.37 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.863 -179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 t -78.87 -22.92 45.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -86.27 163.34 17.78 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.753 0.787 . . . . 0.0 112.847 -176.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -108.12 4.5 24.99 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.112 -178.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.422 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 9.8 p -167.32 154.9 8.97 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.693 0.797 . . . . 0.0 108.949 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.494 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.17 -31.8 66.26 Favored 'General case' 0 C--O 1.194 -1.866 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.616 -175.925 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.422 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 6.1 p-10 -72.23 -28.54 63.23 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.537 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 8.8 tp10 -73.63 -44.21 57.52 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -41.22 98.64 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-O 120.969 0.414 . . . . 0.0 109.94 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.47 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -55.85 -48.52 75.38 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 124.349 1.059 . . . . 0.0 108.293 171.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.3 t-80 -61.82 -57.91 10.0 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.732 1.213 . . . . 0.0 111.859 -175.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.601 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -66.41 -30.26 70.59 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.629 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -76.11 -34.22 59.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.438 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.606 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -65.11 -31.41 72.6 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 176.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 24.8 mm-40 -65.76 -50.14 65.82 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.954 0.883 . . . . 0.0 109.392 174.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -62.26 -45.24 94.16 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.101 -179.648 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.626 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -68.79 -34.84 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.677 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -176.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 34.0 t80 -55.63 -54.45 43.97 Favored 'General case' 0 C--O 1.271 2.223 0 C-N-CA 124.515 1.126 . . . . 0.0 110.471 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.3 ptpt -66.83 -32.45 73.73 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.83 -176.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.38 -41.67 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 O-C-N 123.152 0.283 . . . . 0.0 110.5 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 58.0 mt-30 -62.73 -51.54 66.76 Favored 'General case' 0 CA--C 1.478 -1.805 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.604 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.1 OUTLIER -70.89 -26.81 63.4 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.409 -178.853 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.17 -52.59 64.67 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -64.33 -39.46 93.94 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.968 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.618 ' O ' ' HB3' ' A' ' 84' ' ' ARG . 45.6 mt-10 -59.53 -53.25 60.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 123.555 0.534 . . . . 0.0 111.345 177.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 77' ' ' LYS 0.266 13.1 pt-20 -76.69 -35.51 57.85 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -177.091 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.74 -37.5 67.69 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 118.976 -1.089 . . . . 0.0 111.8 -178.334 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.531 ' HG3' ' HA ' ' B' ' 137' ' ' LEU . 1.1 tmt_? -78.72 -46.28 19.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.788 0.327 . . . . 0.0 110.522 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.618 ' HB3' ' O ' ' A' ' 80' ' ' GLU . 44.7 ttt180 -96.3 -59.19 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -173.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 56.7 m -151.38 89.83 1.53 Allowed 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -170.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 5.9 ptp180 -138.33 -1.5 1.91 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.551 0.691 . . . . 0.0 109.343 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--O 1.253 1.275 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.289 -177.759 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.14 0 N-CA-C 110.684 -0.967 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -68.63 107.38 2.95 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.171 0.51 . . . . 0.0 110.892 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 15.6 tpt 64.0 92.98 0.06 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.7 1.6 . . . . 0.0 112.365 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 33.2 p -87.03 134.26 33.51 Favored 'General case' 0 N--CA 1.417 -2.109 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -87.32 16.71 5.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.427 0.632 . . . . 0.0 110.782 -176.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -150.26 173.23 14.2 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 125.767 1.627 . . . . 0.0 108.174 173.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.61 -44.9 1.19 Allowed Glycine 0 C--N 1.3 -1.433 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 64.4 12.73 7.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.504 1.522 . . . . 0.0 114.015 169.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -62.02 -49.32 76.51 Favored 'General case' 0 CA--C 1.497 -1.058 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -175.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 17.6 m -56.02 -44.76 79.03 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.624 0.578 . . . . 0.0 110.782 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.29 -48.96 60.15 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.39 -178.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -66.08 -32.43 73.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.694 -177.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.78 -47.28 84.19 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.95 0.781 . . . . 0.0 109.379 175.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 110' ' ' THR . 94.8 mt -56.33 -41.56 76.27 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.778 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.83 -64.9 0.69 Allowed 'General case' 0 C--N 1.347 0.465 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.157 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.47 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 8.9 t -62.48 -33.42 74.81 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -174.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 27.2 p -70.77 -50.89 31.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -76.05 -46.49 28.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 119.136 -1.026 . . . . 0.0 112.308 -177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 9.7 m -59.55 -50.89 72.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -172.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.78 -23.14 58.47 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.7 t -76.57 -33.11 58.5 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -62.67 -47.02 85.5 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.93 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 17.5 m -63.37 -33.7 76.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.353 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.53 86.05 2.23 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-O 120.769 0.318 . . . . 0.0 110.528 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 134.86 -57.97 0.69 Allowed Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 108.56 -101.5 1.57 Allowed Glycine 0 N--CA 1.426 -1.992 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.114 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -159.1 51.14 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.6 p -129.6 97.8 4.64 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -78.97 57.15 4.33 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-N 116.203 -0.453 . . . . 0.0 112.994 -177.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -95.38 57.19 1.69 Allowed Glycine 0 N--CA 1.436 -1.324 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -178.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -87.97 44.5 3.23 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 112.319 -0.312 . . . . 0.0 112.319 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' SER . . . . . 0.476 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 29.3 t -168.81 162.09 11.32 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 164.22 -179.68 38.94 Favored Glycine 0 N--CA 1.426 -1.988 0 N-CA-C 107.434 -2.266 . . . . 0.0 107.434 -178.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 156.51 -89.71 0.12 Allowed Glycine 0 C--N 1.298 -1.554 0 C-N-CA 119.327 -1.416 . . . . 0.0 112.583 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 148.3 -127.79 2.66 Favored Glycine 0 N--CA 1.425 -2.097 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.668 -177.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 17.0 p -72.99 47.93 0.2 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.531 ' HA ' ' HG3' ' A' ' 83' ' ' ARG . 5.6 mp -105.15 -26.85 11.91 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 121.428 -0.795 . . . . 0.0 110.258 175.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.1 -47.79 60.34 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.601 -1.181 . . . . 0.0 113.922 -175.202 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 78.0 m -61.9 -21.02 64.37 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.83 -32.67 25.16 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 121.238 0.542 . . . . 0.0 109.992 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 10.4 ttm -81.3 -18.58 45.33 Favored 'General case' 0 C--O 1.257 1.471 0 C-N-CA 123.358 0.663 . . . . 0.0 111.857 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.574 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 32.8 mt-10 -48.89 -27.5 3.12 Favored 'General case' 0 C--O 1.191 -1.992 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -178.026 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 1.6 m -57.62 -59.61 4.93 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 119.415 1.007 . . . . 0.0 109.881 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' ILE . . . . . 0.413 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.7 pp -71.06 -24.24 24.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.748 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.574 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 9.4 mm -72.0 -45.65 62.82 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.389 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.755 175.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.479 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 96.8 mtt180 -63.69 -35.9 82.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 117.833 0.288 . . . . 0.0 110.902 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.1 m -62.12 -50.66 71.02 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.874 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.73 -40.7 98.03 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.474 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -75.67 -22.75 56.44 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.64 -0.663 . . . . 0.0 112.492 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 41.3 tpp -69.62 -26.18 64.31 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 173.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 19.5 t70 71.81 17.44 5.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.723 1.609 . . . . 0.0 111.471 172.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.323 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.686 179.754 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.135 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.418 HG13 ' HE3' ' A' ' 4' ' ' LYS . 39.0 t 62.5 84.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 0.0 111.482 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.36 22.16 5.61 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.263 177.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.418 ' HE3' HG13 ' A' ' 2' ' ' VAL . 14.8 pttp -55.88 102.79 0.08 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.104 172.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.77 -24.63 4.31 Favored Glycine 0 N--CA 1.47 0.914 0 C-N-CA 125.603 1.573 . . . . 0.0 116.964 -168.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.414 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 68.5 p-90 -62.59 -16.87 58.56 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -12.59 54.24 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.987 0.423 . . . . 0.0 112.072 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.78 -26.01 34.81 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 109.818 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -90.87 2.75 55.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.687 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.462 HG23 HD12 ' A' ' 14' ' ' LEU . 7.6 p -135.6 110.52 11.42 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-O 121.535 0.683 . . . . 0.0 109.501 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.43 171.12 8.9 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.991 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -53.47 -43.57 68.26 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 124.298 0.999 . . . . 0.0 110.807 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -52.53 -44.23 65.62 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.599 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -75.72 -47.54 25.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -172.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' HG23 ' A' ' 19' ' ' VAL . 10.0 ptm180 -65.68 -44.72 85.36 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.486 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -68.93 -23.12 64.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 121.261 0.553 . . . . 0.0 109.545 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.669 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 34.3 t60 -68.38 -44.75 74.48 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 174.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.599 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.7 OUTLIER -63.12 -37.66 88.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 119.217 -0.993 . . . . 0.0 109.725 176.613 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.6 t -54.27 -46.74 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.586 0.554 . . . . 0.0 109.781 175.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.522 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 53.9 t-80 -61.05 -41.59 96.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.048 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.49 ' HE2' ' OE1' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -73.26 -31.34 64.03 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.167 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 19' ' ' VAL . 88.0 mt -56.9 -42.51 80.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 173.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 24.0 t -59.36 -53.53 46.91 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.848 172.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.49 ' OE1' ' HE2' ' A' ' 21' ' ' LYS . 46.3 mt-30 -61.76 -26.34 68.02 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.65 -46.99 13.56 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.562 177.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.651 HD11 HG23 ' B' ' 145' ' ' ILE . 4.7 tt -71.86 -29.65 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 122.111 0.957 . . . . 0.0 109.943 -177.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.461 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 79.7 t80 -130.23 83.43 63.02 Favored Pre-proline 0 N--CA 1.4 -2.954 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.306 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.48 84.03 0.13 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.58 2.186 . . . . 0.0 107.959 170.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.0 t -58.35 142.62 81.41 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.401 -171.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.11 -30.93 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.345 2.03 . . . . 0.0 110.57 174.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -146.12 139.77 14.87 Favored Pre-proline 0 CA--C 1.506 -0.75 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 -175.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -54.46 -22.13 26.41 Favored 'Trans proline' 0 CA--C 1.563 1.935 0 C-N-CA 122.668 2.245 . . . . 0.0 114.168 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.68 -10.0 59.72 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 121.199 -0.938 . . . . 0.0 112.105 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -80.39 -7.94 59.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 109.694 176.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 40' ' ' MET . 35.6 mt -86.93 2.73 48.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.225 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -133.12 16.12 4.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.544 0.688 . . . . 0.0 109.467 178.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 40' ' ' MET . 24.3 t70 -81.48 176.98 9.23 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.037 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.532 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.67 -22.78 62.44 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.918 -0.488 . . . . 0.0 111.725 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -73.1 -22.03 60.64 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.624 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.2 tpp -61.3 -45.61 93.74 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.838 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -59.62 -30.72 68.9 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.766 -0.773 . . . . 0.0 111.155 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -72.34 -46.05 57.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.068 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.13 -42.11 76.46 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.478 -178.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.624 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.7 p -73.26 -30.84 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.573 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.68 91.97 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.544 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -59.67 -48.36 81.96 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.272 175.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.32 97.17 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 120.617 0.246 . . . . 0.0 110.964 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -65.11 -45.4 85.28 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.5 pttp -62.47 -40.98 98.41 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.419 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.0 t -65.07 -52.78 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.991 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.214 179.268 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 15.1 tm-20 -57.65 -48.28 79.93 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.906 0.883 . . . . 0.0 109.652 -178.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.62 -40.52 94.78 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.963 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.28 -54.28 47.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.401 0.619 . . . . 0.0 110.5 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.5 ptp -68.75 -30.05 68.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -66.84 -38.41 86.33 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.831 0.824 . . . . 0.0 108.936 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -82.48 -25.62 33.36 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.868 -1.145 . . . . 0.0 112.648 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -82.93 -26.65 31.22 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 120.907 0.384 . . . . 0.0 111.898 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.72 155.76 25.36 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -175.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -102.33 -0.29 32.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.097 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 p -156.9 159.3 38.01 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.11 -27.61 62.75 Favored 'General case' 0 C--O 1.17 -3.12 0 C-N-CA 118.288 -1.365 . . . . 0.0 109.504 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.85 -40.35 87.88 Favored 'General case' 0 C--O 1.209 -1.037 0 O-C-N 123.625 0.578 . . . . 0.0 109.501 178.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.8 -45.52 85.91 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.82 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -47.55 82.61 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.441 ' HD1' ' N ' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -51.2 -48.63 61.94 Favored 'General case' 0 C--O 1.21 -0.988 0 C-N-CA 125.892 1.677 . . . . 0.0 109.756 174.055 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 28.7 t-80 -74.15 -49.39 23.9 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.676 -169.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -67.73 -29.46 68.7 Favored 'General case' 0 C--O 1.249 1.065 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.502 -178.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -73.22 -40.03 65.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.171 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.55 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.1 -34.5 75.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 123.381 0.425 . . . . 0.0 109.93 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 7.4 mm-40 -63.68 -46.28 86.28 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.362 0.665 . . . . 0.0 111.005 175.097 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.32 -36.97 69.02 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.345 -0.942 . . . . 0.0 112.108 -178.163 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.604 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -67.03 -38.75 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.516 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.96 -54.51 37.94 Favored 'General case' 0 C--O 1.254 1.329 0 C-N-CA 124.824 1.25 . . . . 0.0 111.271 175.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -66.04 -33.84 76.72 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.461 -175.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.71 -44.31 96.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 123.439 0.462 . . . . 0.0 111.103 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.2 mt-30 -61.27 -50.75 71.74 Favored 'General case' 0 CA--C 1.49 -1.341 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -176.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.615 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -73.62 -29.17 62.2 Favored 'General case' 0 N--CA 1.395 -3.221 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.961 -177.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 28.4 tt0 -62.61 -52.62 62.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.843 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 3.9 pp -60.61 -45.45 93.96 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 123.818 0.699 . . . . 0.0 110.813 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 84' ' ' ARG . 7.8 tp10 -59.55 -53.72 54.83 Favored 'General case' 0 N--CA 1.401 -2.923 0 O-C-N 123.898 0.749 . . . . 0.0 111.29 -178.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.1 pt-20 -71.92 -34.27 68.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 119.769 -0.772 . . . . 0.0 113.043 -176.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.477 ' HB2' ' NZ ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -75.5 -41.04 56.3 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.482 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.09 -41.66 61.34 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -176.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 80' ' ' GLU . 13.1 ttm180 -67.62 -38.12 83.46 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 175.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 54.7 m 84.12 84.69 0.03 OUTLIER 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 113.59 -1.641 . . . . 0.0 112.642 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -71.2 -27.04 63.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 78.3 mt . . . . . 0 C--O 1.245 0.824 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.485 -178.628 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.764 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 22.9 t -91.83 114.15 26.61 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.3 mmt -80.96 81.96 7.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.138 0.494 . . . . 0.0 110.28 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.0 t -154.62 148.15 25.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -137.58 176.28 8.84 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -118.49 176.34 5.3 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 174.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.97 -48.3 4.03 Favored Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.776 -176.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.469 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 41.5 p-10 -71.33 -8.59 54.72 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 125.245 1.418 . . . . 0.0 110.42 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -58.75 -51.81 68.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.795 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 47.4 m -58.75 -39.0 79.67 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.846 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.49 -54.9 21.62 Favored 'General case' 0 C--O 1.247 0.957 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.949 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 0.0 OUTLIER -73.07 -25.14 60.8 Favored 'General case' 0 C--O 1.247 0.971 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.574 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -60.1 -51.27 70.34 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.88 -45.61 86.11 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.935 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.12 -61.51 2.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.471 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.5 m -60.21 -40.61 90.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.424 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' B' ' 121' ' ' SER . 60.7 p -77.39 -35.12 54.64 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.039 -174.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.1 -49.86 32.87 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.624 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.669 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 37.9 t -70.39 -55.02 10.1 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -177.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.61 -46.99 13.61 Favored 'General case' 0 N--CA 1.426 -1.645 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.628 -172.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.562 ' HB3' ' O ' ' B' ' 117' ' ' SER . 22.6 t -76.78 -41.98 42.55 Favored 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -176.317 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -89.77 -72.82 0.54 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 118.357 -1.337 . . . . 0.0 111.689 -177.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 75.5 m 171.77 -165.53 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.267 1.827 . . . . 0.0 106.122 -173.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.16 75.19 5.71 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.039 0.923 . . . . 0.0 109.75 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 99.92 110.79 3.21 Favored Glycine 0 N--CA 1.432 -1.592 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -57.19 155.72 16.38 Favored Glycine 0 C--O 1.246 0.886 0 CA-C-N 116.635 0.217 . . . . 0.0 113.613 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -64.91 -38.93 96.12 Favored Glycine 0 C--O 1.225 -0.462 0 N-CA-C 114.158 0.423 . . . . 0.0 114.158 -176.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.2 m -76.03 -12.35 60.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.506 0.67 . . . . 0.0 110.576 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 135.78 104.72 0.77 Allowed Glycine 0 N--CA 1.418 -2.542 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -76.06 68.72 2.27 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 127.39 -167.73 19.68 Favored Glycine 0 N--CA 1.422 -2.245 0 N-CA-C 109.706 -1.358 . . . . 0.0 109.706 -176.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 13.3 t -143.05 146.76 34.12 Favored 'General case' 0 N--CA 1.426 -1.659 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -104.65 -144.81 13.35 Favored Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.93 -70.17 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.286 -0.959 . . . . 0.0 112.057 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 142.06 -113.91 0.85 Allowed Glycine 0 N--CA 1.424 -2.106 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.714 -177.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -92.59 31.09 1.4 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.74 -16.94 49.5 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.692 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.461 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.63 -24.6 49.51 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.555 0.693 . . . . 0.0 111.219 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 43.3 t -53.73 144.43 18.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.873 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 77.21 -33.78 0.2 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.215 1.006 . . . . 0.0 112.953 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.843 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 15.3 ttt -80.88 -27.02 36.46 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.602 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.6 mt-10 -48.57 -27.99 3.14 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -178.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.0 p -56.93 -59.7 4.66 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 121.671 0.748 . . . . 0.0 111.485 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.19 -24.3 24.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.406 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.651 HG23 HD11 ' A' ' 26' ' ' ILE . 14.8 mm -63.43 -46.45 95.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.79 173.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -59.85 -42.61 94.03 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 123.994 0.809 . . . . 0.0 109.19 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.5 m -66.33 -34.07 77.14 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.762 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -47.33 22.99 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.482 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.1 pp -66.94 -25.25 66.26 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 50.5 tpp -58.32 -45.66 87.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 175.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.6 t70 67.84 -57.13 0.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 112.851 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.294 -1.82 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.956 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 114.176 0.43 . . . . 0.0 114.176 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -67.18 -19.24 65.54 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -71.32 -10.21 59.38 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 119.765 -0.774 . . . . 0.0 113.017 -175.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -83.69 -7.12 59.55 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.762 0.791 . . . . 0.0 109.185 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -99.81 7.14 45.23 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.001 -177.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.8 p -139.54 114.67 7.96 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.526 0.679 . . . . 0.0 109.348 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.1 166.28 13.5 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -49.13 -41.61 36.69 Favored 'General case' 0 C--O 1.206 -1.224 0 C-N-CA 124.351 1.061 . . . . 0.0 111.154 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -52.06 -47.07 65.3 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.203 0.601 . . . . 0.0 111.925 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.414 HD13 HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.05 -45.83 59.32 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.3 ptm180 -70.07 -42.58 72.6 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.752 -177.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.9 t -67.89 -26.74 66.15 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.602 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 8.7 t60 -70.7 -43.35 69.18 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 176.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.657 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -65.36 -37.91 88.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.478 176.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -57.05 -45.43 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 173.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 12.2 t-80 -57.98 -44.97 87.41 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.58 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.1 mptp? -64.36 -38.17 90.09 Favored 'General case' 0 CA--C 1.506 -0.713 0 C-N-CA 119.977 -0.689 . . . . 0.0 112.635 177.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.4 mt -54.75 -44.92 74.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 123.381 0.426 . . . . 0.0 109.88 176.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.433 ' HA ' HG22 ' A' ' 26' ' ' ILE . 54.0 t -63.83 -48.4 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.812 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 35.4 mt-30 -60.25 -27.96 67.66 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 120.954 0.407 . . . . 0.0 111.906 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.583 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.21 -46.58 14.61 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.772 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.544 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.7 tt -71.35 -30.18 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.699 0.762 . . . . 0.0 110.12 -176.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.454 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 70.9 t80 -127.89 103.87 21.14 Favored Pre-proline 0 N--CA 1.409 -2.494 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.341 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.454 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 57.1 Cg_endo -67.57 76.5 0.54 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.848 2.365 . . . . 0.0 110.463 175.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 13.0 t -60.46 126.42 84.56 Favored Pre-proline 0 N--CA 1.423 -1.807 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.976 -175.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -73.18 -29.91 11.1 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.341 2.027 . . . . 0.0 111.574 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -146.9 143.87 19.12 Favored Pre-proline 0 C--N 1.308 -1.233 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.416 ' HA ' HD12 ' A' ' 35' ' ' LEU . 6.9 Cg_endo -53.74 -18.28 11.93 Favored 'Trans proline' 0 CA--C 1.557 1.634 0 C-N-CA 122.652 2.235 . . . . 0.0 114.05 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.56 -13.41 59.55 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.566 -0.709 . . . . 0.0 112.469 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.448 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -78.36 -6.53 55.43 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.452 1.12 . . . . 0.0 108.747 175.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.462 ' HA ' ' HE2' ' A' ' 40' ' ' MET . 21.8 mt -89.97 7.75 35.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.383 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.72 18.55 4.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.817 0.818 . . . . 0.0 109.323 173.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.598 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 20.5 t70 -80.79 173.78 12.27 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.477 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.598 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -65.5 -24.98 67.27 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 121.955 -0.465 . . . . 0.0 110.901 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 33.1 ttm180 -74.9 -22.35 58.68 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.739 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.0 tpp -59.4 -45.22 92.1 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.732 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -56.3 -36.09 68.27 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.199 0.524 . . . . 0.0 109.866 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -76.15 -43.87 40.86 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.377 1.071 . . . . 0.0 111.372 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 78.6 mt -70.04 -40.86 74.87 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.696 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.739 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.32 -30.7 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.896 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -61.21 -49.17 78.21 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 174.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.61 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 6.8 t80 -57.96 -44.44 87.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.674 0.79 . . . . 0.0 110.215 174.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.64 87.87 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.636 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -68.82 -40.3 79.57 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 1.4 ptmt -65.44 -41.74 93.16 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.359 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.7 t -65.5 -52.7 48.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.629 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -57.78 -51.28 70.21 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.648 0.779 . . . . 0.0 110.015 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -39.18 93.33 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 123.495 0.497 . . . . 0.0 112.941 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.96 -51.63 68.46 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.442 0.639 . . . . 0.0 110.91 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 2.3 ptp -73.59 -27.59 61.38 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.321 -0.854 . . . . 0.0 113.272 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -62.03 -47.39 84.94 Favored 'General case' 0 C--O 1.2 -1.503 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -74.04 -22.62 59.49 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 t -77.54 -32.26 53.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.96 169.46 11.52 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -120.29 17.61 12.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.911 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.7 p -167.88 151.11 5.92 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.55 -33.34 73.91 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.185 -177.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -65.65 -36.96 85.19 Favored 'General case' 0 C--O 1.198 -1.615 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.285 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 9.4 tp10 -67.84 -46.45 71.76 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.63 99.25 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.762 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -48.72 78.9 Favored 'General case' 0 C--O 1.206 -1.22 0 C-N-CA 123.766 0.826 . . . . 0.0 109.054 172.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.417 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m170 -61.23 -55.91 26.62 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.6 pp -64.9 -29.65 70.6 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 18' ' ' LEU . 0.3 OUTLIER -76.04 -39.19 56.09 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.522 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.8 -29.12 69.94 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 123.02 0.528 . . . . 0.0 109.642 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 72.7 mm-40 -67.81 -53.04 30.11 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.291 0.637 . . . . 0.0 111.656 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.42 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -66.16 -35.65 81.03 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 119.338 -0.945 . . . . 0.0 111.46 -177.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.567 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.99 -40.24 80.69 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.8 t80 -52.29 -54.56 29.85 Favored 'General case' 0 C--O 1.257 1.489 0 C-N-CA 125.047 1.339 . . . . 0.0 111.416 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 74' ' ' LYS . 16.1 ptpt -67.86 -35.46 78.59 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.017 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -62.39 -39.69 85.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 O-C-N 123.424 0.453 . . . . 0.0 110.83 177.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.583 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 46.6 mt-30 -64.36 -55.62 19.88 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 123.518 0.511 . . . . 0.0 110.822 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.3 ptpt -68.0 -28.66 67.61 Favored 'General case' 0 N--CA 1.417 -2.084 0 C-N-CA 119.632 -0.827 . . . . 0.0 112.459 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 82' ' ' LYS . 13.5 tp10 -58.57 -53.16 61.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 123.639 0.587 . . . . 0.0 109.833 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -67.34 -38.94 85.65 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 123.199 0.312 . . . . 0.0 111.708 -177.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -62.73 -53.16 58.6 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.541 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.7 pt-20 -72.06 -34.32 68.65 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 120.174 -0.61 . . . . 0.0 112.307 -176.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.498 -1.034 0 C-N-CA 119.594 -0.843 . . . . 0.0 111.609 -178.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.442 -0.835 0 CA-C-O 121.067 0.46 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -72.95 -39.97 65.77 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.314 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -63.49 -43.22 97.88 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.066 0.46 . . . . 0.0 111.076 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -66.89 -36.74 82.98 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 122.721 0.408 . . . . 0.0 110.77 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 61.6 tp -56.57 -53.85 52.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.43 -45.73 90.72 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.954 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.6 m -57.02 -36.14 70.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.985 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 38.5 m -77.27 -58.42 3.28 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.231 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.32 -60.12 4.36 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 C--N 1.308 -1.224 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.664 -171.469 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.609 ' O ' HG12 ' B' ' 145' ' ' ILE . 14.3 tpt . . . . . 0 C--O 1.208 -1.092 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 38.5 mt-10 -58.85 -27.28 64.99 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 24.8 t -61.57 -54.29 45.05 Favored 'General case' 0 C--O 1.249 1.066 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.543 HD11 ' SD ' ' B' ' 141' ' ' MET . 49.3 pt -66.01 -29.26 46.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.609 HG12 ' O ' ' B' ' 141' ' ' MET . 14.2 mm -64.16 -43.39 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.813 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 20.7 mtm180 -59.1 -42.51 90.65 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 48.3 m -59.94 -41.65 92.28 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.517 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 144' ' ' ILE . 28.9 mt-10 -77.2 -38.42 51.52 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.888 -0.508 . . . . 0.0 112.358 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.55 HD23 HG22 ' B' ' 145' ' ' ILE . 4.4 pp -75.36 -24.87 57.33 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 58.5 ttp . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -176.886 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.307 0 N-CA-C 116.081 1.193 . . . . 0.0 116.081 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.1 p-90 -74.03 -7.09 51.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.06 0.93 . . . . 0.0 111.079 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -55.28 -25.03 31.4 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -87.26 0.24 55.68 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.431 0.634 . . . . 0.0 111.725 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -106.7 7.05 30.27 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.711 0.767 . . . . 0.0 109.907 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.99 110.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.698 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.442 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -91.05 160.03 15.81 Favored 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -176.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -38.36 67.69 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.127 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.38 -39.16 85.62 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 120.901 0.381 . . . . 0.0 111.489 -177.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.08 -48.75 61.87 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -68.3 -38.99 82.17 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.738 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.9 t -65.15 -29.85 70.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.766 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 66.2 t60 -69.64 -42.63 74.02 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.46 176.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.593 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -60.88 -38.68 86.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 97.9 t -59.08 -51.04 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 121.296 0.569 . . . . 0.0 109.673 174.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -51.29 -47.88 62.44 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.576 1.15 . . . . 0.0 110.605 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.766 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 54.7 mttm -67.99 -37.86 81.98 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 86.9 mt -54.7 -42.88 72.01 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.69 -52.05 65.42 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.938 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.336 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -74.1 -14.51 60.99 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.711 -0.796 . . . . 0.0 112.936 -175.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.27 -46.27 15.02 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.757 173.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 5.0 tt -72.72 -28.93 28.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.618 0.723 . . . . 0.0 109.866 -177.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -132.59 92.57 26.95 Favored Pre-proline 0 N--CA 1.401 -2.894 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.216 -175.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.74 91.93 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.423 2.082 . . . . 0.0 107.928 170.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.5 123.23 78.12 Favored Pre-proline 0 N--CA 1.422 -1.872 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.893 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.03 -23.44 12.16 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.115 2.543 . . . . 0.0 111.683 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -143.87 143.04 21.62 Favored Pre-proline 0 CA--C 1.491 -1.302 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.28 -13.64 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 121.496 1.464 . . . . 0.0 110.697 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.32 -14.18 55.76 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.754 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.83 -12.14 60.31 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 122.047 0.927 . . . . 0.0 109.325 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 26.1 mt -83.98 0.61 47.32 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.464 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -133.18 19.01 4.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.91 0.862 . . . . 0.0 109.572 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.493 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.9 t70 -77.37 174.68 10.53 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.692 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.482 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -69.79 -27.41 64.88 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.327 0.585 . . . . 0.0 109.61 176.759 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 14.7 ttm180 -73.48 -21.3 60.46 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.297 0.57 . . . . 0.0 110.053 177.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.532 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -61.28 -40.34 93.74 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.491 177.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.0 pt-20 -62.56 -30.76 71.54 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 118.62 -1.232 . . . . 0.0 109.896 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -70.69 -48.5 54.39 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.71 1.204 . . . . 0.0 110.527 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.7 mt -67.92 -44.78 76.08 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.833 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.532 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.5 p -72.18 -32.34 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.414 -0.515 . . . . 0.0 109.93 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.62 -41.51 99.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.498 0.666 . . . . 0.0 109.319 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -60.56 -50.31 74.03 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.618 173.156 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.84 -40.57 88.96 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.989 0.423 . . . . 0.0 110.964 -177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.8 mttt -65.03 -48.27 74.46 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.301 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 15.0 pttp -63.8 -38.46 91.19 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 46' ' ' TYR . 55.2 t -64.43 -53.3 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.204 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -56.05 -46.81 78.79 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 124.09 0.869 . . . . 0.0 109.696 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.15 99.72 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.646 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -58.07 -53.27 60.1 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 123.292 0.637 . . . . 0.0 110.828 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.3 -32.92 74.22 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 178.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -64.66 -41.99 95.72 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 123.328 0.651 . . . . 0.0 109.56 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.43 -22.09 41.53 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.011 -0.431 . . . . 0.0 111.995 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.1 t -79.14 -54.18 6.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 160.08 14.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -171.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -102.59 -2.1 29.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.588 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.3 m -154.82 160.23 41.11 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.26 -36.9 69.15 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 118.799 -1.16 . . . . 0.0 111.753 -179.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.46 -38.14 83.22 Favored 'General case' 0 C--O 1.197 -1.66 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -47.09 77.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.299 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.09 91.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.53 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.1 OUTLIER -55.98 -48.67 75.41 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 125.66 1.584 . . . . 0.0 109.12 175.167 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -61.25 -55.56 30.54 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 123.842 0.857 . . . . 0.0 111.851 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.56 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.9 pp -68.61 -29.3 67.79 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 120.469 -0.493 . . . . 0.0 111.336 -175.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.593 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.76 -40.94 69.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.516 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.13 -38.07 78.77 Favored 'General case' 0 C--O 1.203 -1.363 0 C-N-CA 123.463 0.705 . . . . 0.0 109.699 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 4.8 mm-40 -60.94 -50.08 74.87 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.188 0.995 . . . . 0.0 111.825 175.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.429 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.77 -35.95 67.55 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 119.222 -0.991 . . . . 0.0 111.642 -177.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.65 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -67.93 -36.96 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.7 -54.23 40.87 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 124.976 1.311 . . . . 0.0 110.985 175.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -32.29 72.01 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.195 -176.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -64.06 -43.8 97.61 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 59.8 mt-30 -63.17 -51.62 65.67 Favored 'General case' 0 CA--C 1.493 -1.241 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.903 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.1 ptpt -72.16 -27.61 62.7 Favored 'General case' 0 N--CA 1.402 -2.852 0 C-N-CA 119.048 -1.061 . . . . 0.0 112.911 -177.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -60.72 -52.87 63.26 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.1 pp -65.38 -35.67 81.67 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.97 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.75 -44.54 73.53 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -71.19 -34.77 71.21 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 121.973 -0.454 . . . . 0.0 111.479 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.491 ' NZ ' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.597 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.354 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.437 -1.094 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.36 -40.13 74.21 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.845 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -61.87 -36.87 82.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.742 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -61.84 -46.88 87.57 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.734 0.646 . . . . 0.0 109.731 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.71 -47.2 74.01 Favored 'General case' 0 C--O 1.249 1.042 0 O-C-N 123.751 0.657 . . . . 0.0 110.081 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.497 HD23 ' CD ' ' A' ' 21' ' ' LYS . 85.8 mt -52.87 -62.05 1.9 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.532 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.53 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 7.3 t -69.08 -25.79 64.61 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.627 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -71.39 -52.12 20.32 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.406 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.536 ' HB2' ' NE2' ' A' ' 17' ' ' HIS . 54.1 m-20 -75.72 -31.97 59.86 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.676 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 47.0 p . . . . . 0 C--N 1.321 -0.665 0 C-N-CA 120.058 -0.657 . . . . 0.0 111.894 -177.692 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.5 ttt . . . . . 0 N--CA 1.431 -1.422 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.7 mt-10 -57.1 -27.9 62.18 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.2 m -67.39 -46.77 72.3 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 120.791 0.329 . . . . 0.0 110.417 178.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.446 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.8 pp -73.16 -27.73 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.726 0.774 . . . . 0.0 109.853 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 8.9 mm -66.77 -44.44 89.3 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.854 174.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.562 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 23.7 ttt180 -64.66 -37.32 87.16 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.367 0.417 . . . . 0.0 110.121 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 11.4 t -63.61 -43.68 96.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.75 -51.36 65.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.179 0.591 . . . . 0.0 111.65 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.576 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.4 pp -66.85 -24.52 66.15 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -176.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 C--O 1.243 0.734 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.866 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 C--O 1.218 -0.852 0 N-CA-C 115.291 0.876 . . . . 0.0 115.291 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.9 p-90 -77.49 -4.21 44.43 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 122.119 -0.636 . . . . 0.0 110.851 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -59.8 -18.09 40.94 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.267 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 11.4 pt-20 -90.32 -10.84 42.61 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.065 0.46 . . . . 0.0 111.059 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 64.6 m-70 -99.93 6.13 45.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.466 0.651 . . . . 0.0 110.575 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.455 HG23 HD12 ' A' ' 14' ' ' LEU . 6.1 p -127.76 110.64 22.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-N 114.913 -1.039 . . . . 0.0 108.304 177.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 m -74.94 150.16 39.16 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.121 -175.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -58.59 -38.36 77.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.305 179.336 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 16.6 m-20 -67.29 -35.62 79.85 Favored 'General case' 0 C--O 1.197 -1.706 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.56 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.455 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -67.6 -50.04 60.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -63.23 -42.01 99.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.831 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.6 t -69.47 -30.35 68.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.666 0.746 . . . . 0.0 110.235 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.616 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 12.7 t60 -75.0 -35.44 62.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.378 -178.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 HD21 ' A' ' 68' ' ' LEU . 1.6 mp -65.63 -37.76 87.46 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 174.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.5 t -57.29 -46.02 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.6 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.0 t-80 -55.96 -47.96 76.69 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.824 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.616 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 3.4 mptp? -64.14 -37.66 88.25 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 178.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 26' ' ' ILE . 91.9 mt -53.53 -47.24 70.14 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.9 t -58.84 -50.85 77.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.218 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.2 mt-30 -60.46 -32.67 71.62 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.46 -43.34 19.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.526 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.55 -30.48 42.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 122.078 0.942 . . . . 0.0 109.552 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -127.95 86.26 58.6 Favored Pre-proline 0 N--CA 1.402 -2.873 0 CA-C-N 114.371 -1.286 . . . . 0.0 108.547 -178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.12 78.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.11 2.54 . . . . 0.0 109.678 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 t -59.28 136.94 88.62 Favored Pre-proline 0 N--CA 1.419 -2.0 0 CA-C-N 114.387 -1.278 . . . . 0.0 113.093 -173.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -75.66 -19.35 16.59 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.774 2.316 . . . . 0.0 111.513 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -160.89 142.61 9.06 Favored Pre-proline 0 CA--C 1.51 -0.594 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -53.41 -21.18 17.36 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 C-N-CA 122.884 2.389 . . . . 0.0 114.352 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.72 60.01 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 121.295 -0.878 . . . . 0.0 112.885 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.19 56.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.023 0.916 . . . . 0.0 109.209 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 40' ' ' MET . 19.4 mt -89.69 7.11 38.38 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.999 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -132.76 19.02 4.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.745 0.783 . . . . 0.0 109.373 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.604 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.8 t70 -82.84 175.51 10.03 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.295 -178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.62 -25.91 62.35 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.901 -0.499 . . . . 0.0 111.008 177.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.6 ttp180 -69.74 -21.44 63.46 Favored 'General case' 0 C--O 1.251 1.144 0 CA-C-O 121.79 0.805 . . . . 0.0 109.597 175.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.682 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.8 tpp -63.03 -41.36 99.51 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.345 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -59.57 -31.66 69.65 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.713 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.474 HD21 HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -75.38 -45.84 36.67 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.004 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.39 -42.53 92.56 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.334 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.682 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.1 p -73.4 -31.15 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.01 -48.4 81.85 Favored 'General case' 0 C--N 1.35 0.588 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -58.92 -46.65 87.43 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.322 175.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.23 94.52 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.07 0.231 . . . . 0.0 110.892 -178.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -62.45 -47.64 83.14 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 16.3 pttp -65.44 -35.58 81.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.109 0.48 . . . . 0.0 110.412 -177.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.772 ' O ' ' HG2' ' A' ' 54' ' ' MET . 42.8 t -70.71 -51.06 39.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.759 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -57.23 -45.51 83.83 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.352 0.661 . . . . 0.0 110.189 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.34 -38.27 96.16 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.874 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HB3' ' HE3' ' A' ' 54' ' ' MET . 21.4 t70 -58.13 -50.8 72.22 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.772 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.7 OUTLIER -65.98 -43.24 88.44 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.931 -175.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -56.59 -42.07 78.07 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.874 0.869 . . . . 0.0 108.774 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -83.2 -13.71 54.84 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.9 m -90.0 -24.76 21.15 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.642 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.99 164.48 11.79 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.586 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -125.22 19.08 8.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 m -158.78 153.85 25.25 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.437 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.56 -39.45 67.43 Favored 'General case' 0 C--O 1.191 -1.979 0 C-N-CA 118.954 -1.099 . . . . 0.0 111.532 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.96 -30.08 71.19 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -72.65 -49.8 29.36 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.811 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -42.48 98.56 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -57.75 -49.12 77.65 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 125.328 1.451 . . . . 0.0 109.781 174.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.3 t-80 -65.16 -50.86 64.33 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 123.223 0.327 . . . . 0.0 111.048 -173.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.6 pp -68.62 -30.99 69.83 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-O 120.991 0.424 . . . . 0.0 111.012 -176.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.7 pp -73.99 -35.54 64.45 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.79 -28.36 69.51 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.961 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 22.5 mm-40 -73.42 -42.58 61.88 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-O 120.994 0.426 . . . . 0.0 111.612 176.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.39 -37.45 74.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 118.626 -1.23 . . . . 0.0 110.632 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.6 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -68.77 -36.48 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.552 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 0.9 OUTLIER -51.4 -53.92 31.85 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.599 1.56 . . . . 0.0 110.801 173.508 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -67.08 -32.92 74.42 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.02 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.61 -42.98 97.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 123.045 0.215 . . . . 0.0 110.983 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.3 mt-30 -63.58 -52.25 61.78 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.567 0.699 . . . . 0.0 110.721 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 15.0 ptpt -71.05 -27.69 63.83 Favored 'General case' 0 N--CA 1.415 -2.179 0 C-N-CA 119.289 -0.964 . . . . 0.0 112.21 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.9 tp10 -59.98 -52.52 65.06 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -61.83 -42.13 98.65 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.791 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -59.26 -53.46 58.02 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.248 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -70.42 -37.04 74.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.461 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.773 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.051 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.78 -50.11 32.82 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . 0.469 HE22 ' HB3' ' A' ' 69' ' ' ALA . 81.1 mm-40 -61.18 -44.37 97.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.609 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.22 -46.79 88.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.036 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.83 -41.7 78.31 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 20.8 mt -60.34 -62.16 2.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.433 176.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 11.1 t -63.76 -26.76 68.79 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -74.86 -56.29 4.92 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.856 0.36 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.1 -41.49 50.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.439 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 29.8 t . . . . . 0 C--N 1.325 -0.494 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 92.2 mmm . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.555 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.285 43.7 mt-10 -47.16 -27.78 1.57 Allowed 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -173.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -73.82 -49.59 24.47 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 119.156 0.889 . . . . 0.0 110.897 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -73.4 -24.4 20.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-O 122.272 1.034 . . . . 0.0 110.079 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.555 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.7 mm -70.75 -35.51 60.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.539 172.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.45 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 38.7 ttt180 -59.08 -40.98 86.93 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.8 m -57.68 -53.34 59.27 Favored 'General case' 0 CA--C 1.553 1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.641 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -66.06 -38.64 88.85 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.474 HD22 HD21 ' A' ' 42' ' ' ASN . 4.1 pp -73.93 -31.45 63.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . 0.436 ' N ' HD12 ' B' ' 149' ' ' LEU . 39.7 tpp . . . . . 0 CA--C 1.504 -0.802 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.441 0 N-CA-C 114.366 0.507 . . . . 0.0 114.366 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -67.27 -6.07 16.81 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -61.64 -30.65 70.85 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 120.861 0.362 . . . . 0.0 111.067 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -71.85 -21.98 61.59 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.376 0.608 . . . . 0.0 111.318 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -87.43 -33.03 19.21 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.888 -176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.532 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.6 p -87.54 110.5 20.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.993 0.901 . . . . 0.0 109.788 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -71.53 149.54 45.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.908 -176.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -37.58 82.57 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -56.79 -42.64 79.84 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.287 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.32 -52.03 21.02 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.763 0.792 . . . . 0.0 109.167 -173.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.8 ptm180 -64.48 -38.5 91.24 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.239 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 t -73.9 -23.98 59.64 Favored 'General case' 0 N--CA 1.424 -1.765 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -70.94 -37.5 72.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -64.84 -40.22 94.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.394 174.359 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 83.9 t -58.84 -45.97 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.364 0.666 . . . . 0.0 109.652 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -55.47 -47.29 76.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.173 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.649 ' HD3' HD23 ' B' ' 115' ' ' LEU . 35.7 mttp -66.21 -36.87 84.17 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.312 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 19' ' ' VAL . 60.4 mt -56.41 -45.39 80.71 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 123.241 0.338 . . . . 0.0 110.188 174.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -48.87 83.98 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 O-C-N 123.772 0.67 . . . . 0.0 111.813 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -71.76 -23.58 61.62 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.502 -176.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.45 -41.34 21.98 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.406 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.551 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.52 -34.36 57.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.61 87.09 56.88 Favored Pre-proline 0 N--CA 1.41 -2.467 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.623 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -68.06 77.3 0.62 Allowed 'Trans proline' 0 C--O 1.262 1.685 0 C-N-CA 122.5 2.133 . . . . 0.0 108.61 168.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.4 t -54.88 143.95 49.29 Favored Pre-proline 0 N--CA 1.427 -1.621 0 CA-C-N 113.444 -1.707 . . . . 0.0 113.142 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.32 -36.31 28.18 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.264 1.976 . . . . 0.0 110.66 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -149.03 142.13 15.77 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -53.81 -21.12 19.27 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.256 2.637 . . . . 0.0 115.307 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.83 -11.06 59.66 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 121.035 -1.041 . . . . 0.0 112.468 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.44 -12.86 60.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.181 0.991 . . . . 0.0 108.758 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -84.2 7.23 19.72 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.463 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -132.98 20.41 4.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.766 0.793 . . . . 0.0 109.791 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 35.4 t70 -86.86 174.97 8.42 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.422 ' H ' ' HD2' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -65.82 -25.22 67.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.944 0.402 . . . . 0.0 110.375 175.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.502 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.9 ttm180 -65.56 -31.37 72.38 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 10.2 tpp -60.73 -39.27 88.01 Favored 'General case' 0 CA--C 1.496 -1.128 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.099 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -33.67 76.51 Favored 'General case' 0 C--O 1.199 -1.555 0 C-N-CA 117.381 -1.727 . . . . 0.0 110.048 -177.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -66.59 -46.29 76.43 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 124.039 0.837 . . . . 0.0 110.386 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 85.8 mt -65.72 -47.05 76.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.928 -177.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.6 p -73.27 -31.87 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.1 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.09 94.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -60.12 -47.41 86.01 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 124.208 1.003 . . . . 0.0 110.322 174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.15 -45.24 94.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.773 -0.194 . . . . 0.0 110.738 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HE2' HG22 ' A' ' 44' ' ' VAL . 62.6 mttm -62.85 -40.04 96.24 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.881 0.472 . . . . 0.0 111.474 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 48.4 pttt -73.55 -36.37 65.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.862 0.363 . . . . 0.0 110.979 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' A' ' 54' ' ' MET . 40.5 t -67.4 -45.92 84.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -54.98 -47.85 74.03 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.831 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.77 97.1 Favored Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.793 -0.64 . . . . 0.0 113.206 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.63 -54.32 48.41 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.762 0.315 . . . . 0.0 110.962 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.594 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 1.8 ptp -70.17 -30.88 68.13 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -60.99 -49.59 76.81 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.456 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 6.1 mm-40 -73.3 -24.31 60.39 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.448 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 37.9 m -76.16 -34.46 59.37 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.852 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.5 164.72 14.69 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.138 0.494 . . . . 0.0 111.967 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.04 15.37 13.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.001 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.5 m -158.4 150.48 21.65 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.532 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.38 -34.34 67.87 Favored 'General case' 0 C--O 1.187 -2.19 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.319 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -69.39 -32.24 71.12 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.874 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.502 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 11.9 tp10 -66.56 -51.68 53.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -39.25 92.23 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.784 -177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.683 ' CE1' HD13 ' B' ' 115' ' ' LEU . 11.9 t80 -61.46 -47.13 87.09 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.145 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.601 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 55.8 m80 -70.68 -43.54 68.84 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.594 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.6 pp -68.53 -31.09 70.07 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 120.379 -0.528 . . . . 0.0 112.186 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.7 OUTLIER -74.48 -39.27 62.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.538 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -54.22 -40.82 68.0 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.681 173.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 45.7 mm-40 -60.16 -48.56 81.23 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.511 0.672 . . . . 0.0 110.577 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 1.6 tptt -62.09 -48.31 80.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.322 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.591 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -34.34 67.35 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.186 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.466 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 5.4 t80 -55.5 -53.52 55.34 Favored 'General case' 0 C--O 1.257 1.477 0 C-N-CA 125.348 1.459 . . . . 0.0 110.943 174.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.7 ptpt -64.35 -34.36 77.97 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.717 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.482 HD13 ' HD2' ' A' ' 71' ' ' LYS . 1.5 mp -63.75 -43.95 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 123.326 0.391 . . . . 0.0 110.49 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.8 mt-30 -64.59 -52.12 59.17 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.9 -176.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.583 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.0 ptpt -71.16 -29.05 64.72 Favored 'General case' 0 N--CA 1.419 -1.997 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.1 -177.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.642 ' O ' ' HG3' ' A' ' 82' ' ' LYS . 48.9 tp10 -63.22 -51.77 64.9 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -64.0 -39.72 94.76 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.548 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -68.52 -44.37 74.76 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.7 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -69.17 -45.15 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 119.869 -0.732 . . . . 0.0 112.199 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 78' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.73 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 41.1 m . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.36 -53.12 48.17 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.481 -176.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . 0.366 0.0 OUTLIER -75.3 -27.61 59.4 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -176.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -73.68 -42.21 61.6 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.483 175.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.54 -45.78 90.79 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.683 HD13 ' CE1' ' A' ' 65' ' ' TYR . 9.0 mt -50.01 -61.77 1.96 Allowed 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.494 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -62.32 -42.29 99.25 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.623 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 41.9 m -63.94 -37.39 87.25 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.307 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -77.06 -53.1 8.21 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.323 -0.567 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -171.103 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.601 ' O ' HG12 ' B' ' 145' ' ' ILE . 7.7 tpt . . . . . 0 N--CA 1.444 -0.77 0 CA-C-O 121.708 0.765 . . . . 0.0 109.117 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.535 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 50.4 mt-10 -52.57 -27.22 15.86 Favored 'General case' 0 C--O 1.199 -1.586 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.9 p -58.06 -59.96 4.47 Favored 'General case' 0 C--O 1.265 1.87 0 CA-C-O 122.083 0.944 . . . . 0.0 110.926 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.465 HD11 ' SD ' ' B' ' 141' ' ' MET . 41.8 pt -64.61 -29.93 48.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.61 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.601 HG12 ' O ' ' B' ' 141' ' ' MET . 17.7 mm -67.25 -40.56 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.007 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 99.1 mtt180 -59.58 -42.01 91.56 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.2 m -58.07 -47.36 83.41 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.903 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.82 -38.4 73.28 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -71.09 -31.19 67.5 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.752 -0.592 . . . . 0.0 110.369 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.277 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.111 0 N-CA-C 114.93 0.732 . . . . 0.0 114.93 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.4 p-90 -72.32 -9.62 58.73 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.71 -15.72 54.09 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 10.9 pt-20 -89.09 -9.3 51.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.288 0.566 . . . . 0.0 110.086 177.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.0 m-70 -96.24 4.23 52.52 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.272 0.558 . . . . 0.0 109.77 -178.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.549 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.1 t -118.46 113.0 40.52 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.412 0 N-CA-C 104.716 -2.328 . . . . 0.0 104.716 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.0 m -65.98 149.93 49.46 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.463 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -57.35 -39.98 77.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.334 0.588 . . . . 0.0 109.503 177.754 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.469 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.1 m-20 -63.96 -35.01 79.29 Favored 'General case' 0 C--O 1.196 -1.719 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.04 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.39 -51.44 15.02 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.464 ' O ' HG23 ' A' ' 19' ' ' VAL . 11.9 ptm180 -59.41 -42.74 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.106 0.479 . . . . 0.0 111.278 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 21.2 t -73.0 -24.84 60.8 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.36 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.592 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 10.3 t60 -74.94 -34.8 62.13 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.339 0.59 . . . . 0.0 109.749 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.494 HD23 HD21 ' A' ' 68' ' ' LEU . 2.0 mp -63.82 -39.14 93.53 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 173.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.8 t -59.05 -49.68 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-O 121.667 0.746 . . . . 0.0 109.464 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.461 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 28.5 t-80 -51.29 -49.46 61.24 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.925 1.29 . . . . 0.0 111.098 177.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 55.2 mttm -64.77 -36.87 85.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.395 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 91.8 mt -56.1 -47.51 77.92 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.389 0.431 . . . . 0.0 110.222 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.88 -49.15 84.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 O-C-N 123.769 0.668 . . . . 0.0 112.007 176.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -70.0 -23.21 63.11 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.449 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.2 -44.23 18.13 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.472 176.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.609 HD11 HG23 ' B' ' 145' ' ' ILE . 4.9 tt -70.73 -32.99 51.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.477 0.656 . . . . 0.0 110.149 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 1.2 m-85 -127.62 93.57 39.98 Favored Pre-proline 0 N--CA 1.416 -2.155 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.1 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 28.3 Cg_endo -66.86 96.42 0.37 Allowed 'Trans proline' 0 N--CA 1.446 -1.32 0 C-N-CA 121.794 1.663 . . . . 0.0 108.141 170.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 11.0 t -74.35 139.17 75.01 Favored Pre-proline 0 N--CA 1.419 -1.978 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.992 -171.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 -28.62 5.83 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.241 2.627 . . . . 0.0 111.717 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -140.23 146.23 44.99 Favored Pre-proline 0 CA--C 1.483 -1.629 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 -177.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -67.26 -12.58 36.43 Favored 'Trans proline' 0 C--N 1.323 -0.774 0 C-N-CA 121.411 1.408 . . . . 0.0 110.787 174.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.15 57.65 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.745 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -77.84 -11.8 59.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.101 0.953 . . . . 0.0 108.654 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.542 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.8 mt -87.79 3.82 46.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.828 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -133.04 21.52 4.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.697 0.761 . . . . 0.0 109.532 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.562 ' O ' ' HB3' ' A' ' 40' ' ' MET . 17.4 t70 -89.08 172.24 9.25 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.716 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.538 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.23 -25.76 65.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.419 0.628 . . . . 0.0 110.928 -178.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 -76.74 -16.21 59.55 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.613 0.72 . . . . 0.0 109.56 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.562 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.5 tpp -65.5 -40.31 92.9 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.182 176.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.5 pt-20 -62.09 -27.88 69.22 Favored 'General case' 0 C--O 1.192 -1.921 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.055 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.48 -47.41 55.67 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.196 0.598 . . . . 0.0 110.565 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.25 -45.96 75.15 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.426 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -72.6 -30.74 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.141 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.43 94.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.6 t80 -56.92 -46.59 81.89 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.675 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.78 -47.8 81.91 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.441 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -62.59 -40.11 95.85 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.14 0.576 . . . . 0.0 112.362 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.8 pttp -72.51 -38.32 68.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.809 0.338 . . . . 0.0 110.681 -177.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.6 t -69.28 -47.08 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -58.71 -47.6 84.02 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.663 0.785 . . . . 0.0 109.34 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.51 -39.73 93.49 Favored Glycine 0 C--O 1.224 -0.507 0 O-C-N 123.644 0.59 . . . . 0.0 112.667 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -59.84 -54.75 42.56 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.946 0.403 . . . . 0.0 111.19 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.46 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -66.74 -32.54 73.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.382 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.29 -49.78 76.25 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 123.902 0.881 . . . . 0.0 109.706 173.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.43 -21.08 60.56 Favored 'General case' 0 C--N 1.31 -1.152 0 O-C-N 122.033 -0.417 . . . . 0.0 111.986 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -84.55 -39.46 18.76 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.63 169.76 15.91 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -174.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.35 6.49 16.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.685 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -164.34 151.57 11.71 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -63.46 -35.77 81.54 Favored 'General case' 0 C--O 1.178 -2.676 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.141 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.17 -36.15 82.66 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 123.923 0.764 . . . . 0.0 110.379 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -71.81 -46.66 57.43 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.826 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -40.42 95.81 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.523 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.433 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.3 OUTLIER -56.15 -49.91 72.65 Favored 'General case' 0 C--O 1.209 -1.045 0 C-N-CA 125.13 1.372 . . . . 0.0 109.369 174.499 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.439 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 35.9 t-80 -64.58 -54.16 36.39 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.419 -172.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.459 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.82 -29.97 69.26 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.447 -177.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.494 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -74.02 -38.26 64.11 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.725 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.7 -32.34 73.41 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 123.398 0.437 . . . . 0.0 109.838 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 12.1 mm-40 -70.85 -41.56 71.29 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 176.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -37.59 66.65 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 118.954 -1.098 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.7 tt -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.54 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.85 -54.12 38.92 Favored 'General case' 0 C--O 1.252 1.205 0 C-N-CA 125.004 1.321 . . . . 0.0 111.269 174.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -67.91 -34.81 77.35 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.911 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.97 -42.81 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 123.558 0.536 . . . . 0.0 110.476 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.4 mt-30 -61.82 -57.02 13.43 Favored 'General case' 0 CA--C 1.484 -1.567 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.081 -178.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.6 ptpt -66.23 -32.5 73.96 Favored 'General case' 0 N--CA 1.418 -2.057 0 C-N-CA 119.78 -0.768 . . . . 0.0 112.839 -176.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -59.45 -52.68 64.56 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -68.2 -41.7 80.96 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.964 -177.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.7 -43.34 99.05 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.6 pt-20 -75.5 -36.66 60.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.657 -177.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.449 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.511 -0.519 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.442 -0.856 0 CA-C-O 120.269 0.081 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.42 -48.29 56.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -60.66 -43.76 97.26 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.291 0.369 . . . . 0.0 111.107 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.71 -38.58 80.35 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.176 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 110' ' ' THR . 81.7 mt -63.16 -38.89 92.97 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.294 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -56.7 -66.58 0.42 Allowed 'General case' 0 C--O 1.214 -0.808 0 O-C-N 123.362 0.414 . . . . 0.0 110.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.433 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 9.0 t -56.96 -46.94 81.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -173.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.1 t -72.21 -46.82 54.6 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.994 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -76.58 -36.34 57.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.542 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 72.6 p . . . . . 0 CA--C 1.504 -0.797 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -177.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.624 ' SD ' HD11 ' B' ' 144' ' ' ILE . 13.9 tpt . . . . . 0 C--O 1.24 0.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.599 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.4 mt-10 -49.66 -26.46 3.71 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.3 p -60.31 -59.47 5.36 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 121.362 0.601 . . . . 0.0 111.534 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.624 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.6 pp -70.78 -24.94 25.4 Favored 'Isoleucine or valine' 0 C--O 1.264 1.826 0 CA-C-O 122.28 1.038 . . . . 0.0 111.469 177.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.609 HG23 HD11 ' A' ' 26' ' ' ILE . 15.2 mm -65.1 -39.29 85.1 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.201 172.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -65.52 -40.7 93.27 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.885 177.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 5.2 p -60.75 -28.87 69.03 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.919 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -79.56 -52.23 8.27 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 119.13 -1.028 . . . . 0.0 112.198 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 2.4 pp -72.88 -23.12 60.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 17.0 tpt . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 109.928 -178.93 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.782 0 N-CA-C 115.578 0.991 . . . . 0.0 115.578 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.442 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 67.5 p-90 -67.46 -9.2 39.68 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -67.09 -17.73 65.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.188 0.518 . . . . 0.0 110.765 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.87 -10.0 59.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 121.243 0.544 . . . . 0.0 109.794 176.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.442 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 15.6 m-70 -96.72 4.55 51.76 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.48 -178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.467 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -138.09 110.66 6.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-O 122.068 0.937 . . . . 0.0 109.363 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -86.63 162.92 17.7 Favored 'General case' 0 N--CA 1.414 -2.245 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.788 -177.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.85 -36.85 77.71 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.754 -178.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -57.25 -45.5 83.93 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' B' ' 119' ' ' SER . 3.3 tm? -69.61 -50.98 39.24 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.718 0.771 . . . . 0.0 108.945 -175.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.544 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.5 ptm180 -66.41 -41.35 89.4 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.064 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.404 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 14.5 t -70.79 -25.36 62.85 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 46.9 t60 -67.66 -40.55 84.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.517 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -65.32 -36.12 83.06 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.078 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -59.55 -44.73 93.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 123.521 0.728 . . . . 0.0 109.358 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.44 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.8 t-80 -58.77 -42.34 88.71 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.127 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.612 ' HD3' HD23 ' B' ' 115' ' ' LEU . 72.7 mttt -71.27 -36.32 71.68 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.1 mt -57.02 -44.09 82.49 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.9 t -58.01 -50.41 78.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 O-C-N 124.117 0.886 . . . . 0.0 111.827 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.65 -17.67 62.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.62 -46.33 13.42 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.452 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.654 HD11 HG23 ' B' ' 145' ' ' ILE . 4.4 tt -70.69 -36.79 66.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 122.05 0.929 . . . . 0.0 108.925 -177.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 5.5 m-85 -130.16 88.06 49.27 Favored Pre-proline 0 N--CA 1.397 -3.087 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.624 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -61.6 94.44 0.12 Allowed 'Trans proline' 0 N--CA 1.438 -1.74 0 C-N-CA 121.878 1.719 . . . . 0.0 108.489 173.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -68.72 136.75 90.26 Favored Pre-proline 0 N--CA 1.401 -2.923 0 CA-C-N 113.883 -1.508 . . . . 0.0 111.68 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.18 -32.52 4.06 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.511 2.141 . . . . 0.0 110.612 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -137.46 146.27 52.88 Favored Pre-proline 0 CA--C 1.482 -1.659 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.122 -174.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -68.5 -11.45 31.98 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.626 1.551 . . . . 0.0 111.446 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.88 -9.23 54.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.57 -13.41 59.92 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.3 mt -84.53 7.24 20.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 113.921 -1.49 . . . . 0.0 110.612 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.87 14.04 4.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.756 0.789 . . . . 0.0 109.613 176.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.6 t70 -81.16 171.04 15.38 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.526 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.435 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.18 -28.57 69.84 Favored 'General case' 0 C--N 1.31 -1.129 0 O-C-N 122.14 -0.35 . . . . 0.0 111.289 -179.157 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.481 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 19.7 ttm180 -70.3 -20.16 63.04 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.574 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.7 tpp -63.84 -42.87 97.5 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.444 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.48 -33.87 73.22 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.86 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -68.69 -48.21 64.48 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 84.7 mt -67.48 -42.08 83.53 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.032 -178.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.574 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.0 p -73.09 -33.55 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -62.07 -48.82 78.49 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 175.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.59 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 1.7 t80 -56.28 -42.89 78.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.099 0.96 . . . . 0.0 110.512 174.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.453 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -69.14 -38.46 78.83 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.986 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.3 mttm -64.36 -39.57 94.14 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 120.67 0.271 . . . . 0.0 111.364 177.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 4.3 ptmt -68.0 -44.14 77.25 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.477 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.2 t -62.32 -50.44 79.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -56.31 -50.06 72.53 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.371 1.068 . . . . 0.0 109.26 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.78 -32.78 80.35 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.137 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -70.07 -49.34 52.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.932 0.396 . . . . 0.0 110.732 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.427 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -65.8 -30.33 70.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 177.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.468 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 78.1 t80 -61.75 -42.35 98.85 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 3.4 mm-40 -82.03 -13.27 57.61 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 t -87.63 -27.14 22.67 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-O 121.105 0.479 . . . . 0.0 110.56 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -95.55 165.83 12.15 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -116.54 8.52 13.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.709 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.0 p -158.42 156.66 30.81 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -32.94 67.35 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.853 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.78 -37.63 88.27 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 178.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -64.96 -47.47 77.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.903 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -40.99 98.32 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.048 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.697 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 7.0 t80 -64.01 -42.98 96.98 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.161 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.505 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.4 m80 -62.77 -57.21 11.73 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.05 176.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.1 pp -64.23 -30.22 71.29 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -173.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.511 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -72.36 -46.51 55.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 175.606 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.512 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -53.86 -34.27 58.88 Favored 'General case' 0 C--O 1.207 -1.16 0 O-C-N 123.825 0.703 . . . . 0.0 110.809 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.707 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 14.1 mt-10 -74.09 -45.35 49.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -67.72 -37.69 82.58 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.944 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 2.4 tt -69.31 -35.67 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.707 ' CD2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -69.45 -38.54 77.82 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.286 -178.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -68.19 -33.29 74.16 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.386 0.428 . . . . 0.0 110.068 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.66 -41.45 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.066 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 49.7 mt-30 -65.37 -45.43 84.12 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 120.957 0.408 . . . . 0.0 110.617 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.5 ptpt -71.41 -26.98 62.99 Favored 'General case' 0 N--CA 1.424 -1.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.72 -47.02 73.66 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -66.38 -34.42 77.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.084 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -65.66 -53.32 42.96 Favored 'General case' 0 N--CA 1.407 -2.579 0 C-N-CA 124.007 0.923 . . . . 0.0 110.314 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -62.29 -38.18 88.38 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.498 ' HE2' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.026 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.426 -1.672 0 CA-C-O 121.043 0.449 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.93 -51.98 16.4 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.535 -173.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -67.52 -36.73 81.6 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.517 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.69 -46.36 82.71 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.006 0.432 . . . . 0.0 110.112 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.83 -44.78 96.48 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.261 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.697 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 21.9 mt -55.09 -67.29 0.28 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.856 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 13.7 t -58.0 -28.91 64.85 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.8 p -73.97 -52.6 12.31 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.809 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.529 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 53.6 m-20 -76.21 -43.74 40.88 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 119.154 -1.018 . . . . 0.0 112.319 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.469 ' HB3' HD22 ' A' ' 14' ' ' LEU . 20.1 m . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 121.547 0.689 . . . . 0.0 111.705 -173.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.498 ' SD ' ' HE2' ' A' ' 82' ' ' LYS . 11.9 tpt . . . . . 0 C--O 1.239 0.501 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.603 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -50.89 -27.13 6.83 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.0 m -58.78 -53.53 57.38 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-O 121.053 0.454 . . . . 0.0 110.681 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . 0.25 2.7 pp -73.92 -24.17 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 121.164 0.506 . . . . 0.0 111.147 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.654 HG23 HD11 ' A' ' 26' ' ' ILE . 13.8 mm -65.17 -42.52 94.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.081 172.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.474 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 49.0 ttp180 -62.08 -37.67 85.91 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.674 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.2 m -56.55 -53.89 52.28 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 123.662 0.601 . . . . 0.0 110.224 172.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.2 -41.54 90.05 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG 0.268 3.4 pp -68.29 -31.23 70.53 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.57 -0.707 . . . . 0.0 111.764 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 C--N 1.318 -0.776 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.454 177.092 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.912 0 N-CA-C 116.424 1.33 . . . . 0.0 116.424 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -79.9 -3.0 46.18 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 121.543 -0.975 . . . . 0.0 110.027 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -60.84 -32.34 71.74 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 125.936 1.695 . . . . 0.0 108.809 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -81.71 -4.26 55.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.147 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -109.23 -15.67 14.24 Favored 'General case' 0 CA--C 1.499 -1.002 0 CA-C-O 121.3 0.571 . . . . 0.0 111.627 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 7.5 p -101.98 109.8 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.179 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -81.22 150.5 28.58 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.256 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.21 -39.96 73.29 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 123.542 0.526 . . . . 0.0 110.146 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -64.07 -33.58 76.08 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.859 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.72 -48.08 34.64 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 8.3 ptm180 -69.8 -41.49 74.97 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.276 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.7 t -70.18 -23.09 62.91 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.484 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 18.8 t60 -71.07 -42.37 69.5 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 68' ' ' LEU . 1.9 mp -62.06 -38.25 88.07 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.463 176.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 93.8 t -60.31 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.19 0.596 . . . . 0.0 109.505 172.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -52.96 -46.61 68.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.699 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.484 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 61.5 mttm -65.66 -39.47 91.4 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.7 mt -55.31 -45.5 76.32 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.358 0.411 . . . . 0.0 110.142 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.9 t -60.49 -55.01 27.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 O-C-N 123.852 0.72 . . . . 0.0 111.187 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.04 -26.74 68.42 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -176.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.52 -45.84 15.35 Favored 'General case' 0 C--O 1.206 -1.228 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.576 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.541 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.2 tt -70.43 -28.35 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 121.952 0.882 . . . . 0.0 109.639 -177.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.1 86.5 51.22 Favored Pre-proline 0 N--CA 1.394 -3.25 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.445 -177.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.76 98.49 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.399 0 C-N-CA 122.244 1.963 . . . . 0.0 107.413 168.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 t -73.61 142.86 81.32 Favored Pre-proline 0 N--CA 1.408 -2.546 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.653 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.53 -24.74 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.385 2.056 . . . . 0.0 111.435 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -155.7 142.61 13.55 Favored Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -174.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.31 -24.68 61.25 Favored 'Trans proline' 0 C--N 1.321 -0.873 0 C-N-CA 122.73 2.287 . . . . 0.0 114.659 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.33 -8.11 58.83 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.248 -0.908 . . . . 0.0 111.936 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.2 -11.39 59.82 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.733 0.777 . . . . 0.0 109.185 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.7 mt -87.73 3.49 47.83 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.262 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.0 19.22 4.1 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 122.534 1.159 . . . . 0.0 109.169 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.0 t70 -83.34 177.77 8.35 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.092 -177.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.29 -33.26 71.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.123 0.487 . . . . 0.0 110.158 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -69.21 -20.33 63.98 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 122.112 0.958 . . . . 0.0 109.935 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.607 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -62.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.696 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 38' ' ' ARG . 0.2 OUTLIER -62.39 -32.77 73.64 Favored 'General case' 0 C--O 1.174 -2.895 0 C-N-CA 118.144 -1.422 . . . . 0.0 110.785 -178.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.21 -47.98 66.43 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.591 0.557 . . . . 0.0 110.872 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.6 -44.64 77.62 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.863 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.607 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.7 p -73.46 -32.72 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.027 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.45 94.58 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.629 0.728 . . . . 0.0 109.094 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.497 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -58.56 -47.09 85.38 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.496 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.01 98.17 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.801 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 94.1 mttt -63.24 -44.0 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.106 0.563 . . . . 0.0 111.315 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.5 pttp -68.46 -39.42 81.43 Favored 'General case' 0 C--O 1.25 1.095 0 CA-C-O 121.307 0.575 . . . . 0.0 110.605 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.42 -50.83 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.687 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -56.71 -48.51 77.55 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.142 0.977 . . . . 0.0 109.668 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.97 -40.24 93.01 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.38 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -61.52 -55.25 33.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-O 120.336 0.112 . . . . 0.0 110.879 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -64.75 -28.61 69.7 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.735 0.642 . . . . 0.0 112.735 179.743 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -64.53 -51.68 61.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -70.64 -24.42 62.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.62 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 64.9 m -82.29 -33.61 29.0 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.5 164.75 18.61 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.326 0.584 . . . . 0.0 112.422 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -113.15 13.6 19.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.402 0.62 . . . . 0.0 111.351 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.6 p -163.78 153.9 15.16 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 171.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -70.36 -33.67 71.72 Favored 'General case' 0 C--O 1.188 -2.177 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.312 -178.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.97 -35.82 82.41 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -67.07 -46.91 72.87 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.286 175.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.63 -44.82 95.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.773 0.671 . . . . 0.0 109.609 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -49.33 75.61 Favored 'General case' 0 C--O 1.208 -1.125 0 C-N-CA 125.077 1.351 . . . . 0.0 109.492 175.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -63.5 -49.61 72.87 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.62 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.5 pp -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.628 -176.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.06 -36.89 58.82 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 177.444 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.613 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -36.56 84.14 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.02 -47.29 83.71 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.633 0.73 . . . . 0.0 110.954 174.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -44.38 93.98 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.5 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.613 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.9 tt -69.58 -35.77 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.374 -177.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.549 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.46 -54.25 43.44 Favored 'General case' 0 C--O 1.26 1.625 0 C-N-CA 124.525 1.13 . . . . 0.0 110.936 175.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.15 -32.4 73.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.374 -176.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.24 -45.71 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.821 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.636 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 36.4 mt-30 -59.28 -53.83 53.75 Favored 'General case' 0 CA--C 1.481 -1.705 0 O-C-N 123.798 0.686 . . . . 0.0 111.364 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.648 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -67.7 -35.22 78.41 Favored 'General case' 0 N--CA 1.415 -2.21 0 C-N-CA 119.192 -1.003 . . . . 0.0 112.524 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 12.0 tp10 -59.98 -48.86 79.96 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.456 HD21 ' O ' ' A' ' 25' ' ' ALA . 4.6 pp -67.11 -43.77 81.64 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.6 -49.85 69.49 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 123.28 0.362 . . . . 0.0 111.356 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -68.36 -31.74 71.33 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? . . . . . 0 N--CA 1.453 -0.294 0 C-N-CA 120.107 -0.637 . . . . 0.0 111.45 178.715 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 5.3 t . . . . . 0 N--CA 1.434 -1.26 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.54 -42.82 67.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.973 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.57 -35.31 79.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -66.52 -44.47 82.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.056 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 110' ' ' THR . 71.8 mt -60.5 -42.73 96.94 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.041 0.448 . . . . 0.0 109.795 177.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.435 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 3.1 mm? -53.63 -59.02 5.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.686 175.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 19.4 m -60.93 -44.14 97.64 Favored 'General case' 0 C--O 1.247 0.929 0 O-C-N 123.858 0.724 . . . . 0.0 111.347 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 44.7 m -62.9 -46.66 86.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.537 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.432 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 17.2 m-20 -76.22 -41.36 49.55 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 118.556 -1.258 . . . . 0.0 111.835 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 53.7 p . . . . . 0 C--N 1.326 -0.431 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -173.423 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 144' ' ' ILE . 10.8 tpt . . . . . 0 C--O 1.246 0.906 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.633 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.2 mt-10 -47.53 -26.17 1.34 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.2 m -55.94 -59.26 5.15 Favored 'General case' 0 C--O 1.259 1.599 0 CA-C-O 121.701 0.762 . . . . 0.0 111.138 174.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' B' ' 141' ' ' MET 0.291 2.6 pp -72.52 -23.59 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 O-C-N 121.356 -0.84 . . . . 0.0 111.674 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.633 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 29.2 mm -67.39 -38.55 80.99 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.801 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.675 172.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.433 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 15.2 tpp180 -59.14 -43.96 92.04 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.2 m -58.37 -48.16 81.51 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.598 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -72.07 -37.35 69.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.433 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.9 pp -68.34 -24.58 64.83 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.332 -0.855 . . . . 0.0 110.27 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.3 tpt . . . . . 0 N--CA 1.437 -1.081 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 173.11 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.376 0 N-CA-C 114.404 0.521 . . . . 0.0 114.404 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.521 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 65.4 p-90 -63.91 -19.89 65.44 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -61.94 -20.72 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.277 0.56 . . . . 0.0 111.393 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -82.5 -10.78 58.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -108.58 8.31 27.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.867 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.434 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -129.66 118.54 45.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 CA-C-O 121.317 0.579 . . . . 0.0 110.043 -177.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -85.8 153.1 22.51 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.287 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -38.29 70.09 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-O 121.016 0.436 . . . . 0.0 110.765 177.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.73 -27.72 65.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.434 HD12 HG23 ' A' ' 10' ' ' VAL . 2.6 tm? -73.38 -51.15 18.39 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.1 ptm180 -64.78 -38.28 90.45 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.837 -179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.412 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.8 t -70.01 -26.41 64.05 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -73.53 -36.17 65.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.538 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -63.43 -39.13 93.65 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 70.2 t -59.19 -49.93 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.405 0.682 . . . . 0.0 109.31 172.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -52.31 -46.33 65.95 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 124.569 1.148 . . . . 0.0 110.814 176.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.414 ' CE ' ' HB2' ' B' ' 118' ' ' ASP . 55.0 mttm -64.15 -42.36 96.81 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.277 177.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 19' ' ' VAL . 89.4 mt -54.63 -46.06 73.83 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -57.38 -49.97 78.43 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.758 175.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -68.03 -24.15 65.07 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.554 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.37 -46.34 16.21 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.003 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.56 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.9 tt -70.89 -29.33 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.958 0.885 . . . . 0.0 110.003 -178.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -127.14 90.74 48.41 Favored Pre-proline 0 N--CA 1.401 -2.901 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.025 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -55.64 127.31 25.63 Favored 'Trans proline' 0 N--CA 1.447 -1.244 0 C-N-CA 122.398 2.065 . . . . 0.0 108.22 170.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 p -70.46 120.59 79.61 Favored Pre-proline 0 C--N 1.283 -2.308 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -87.17 -26.5 0.82 Allowed 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.067 1.178 . . . . 0.0 109.046 167.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -154.13 140.61 12.9 Favored Pre-proline 0 CA--C 1.495 -1.149 0 C-N-CA 125.471 1.508 . . . . 0.0 107.225 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -67.42 -19.48 49.24 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.276 1.318 . . . . 0.0 110.586 171.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.61 -6.81 59.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -13.99 59.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 122.333 1.063 . . . . 0.0 108.43 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.0 4.49 16.82 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.102 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.41 22.92 3.73 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.16 0.505 . . . . 0.0 110.987 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.482 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 10.2 t70 -87.56 -176.99 5.78 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.482 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.3 -17.44 62.46 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 119.823 1.192 . . . . 0.0 110.418 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 21.9 ttm180 -70.97 -20.31 62.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.404 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.68 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.8 tpp -66.94 -42.89 84.52 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.07 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.8 pt-20 -59.86 -29.53 68.36 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.062 -0.655 . . . . 0.0 109.869 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.42 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.3 t30 -73.61 -51.53 16.52 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 124.571 1.148 . . . . 0.0 110.346 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.22 -44.17 80.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.749 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.68 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -72.62 -33.33 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.893 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.071 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.57 -45.26 89.38 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.583 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.0 t80 -60.41 -50.49 73.37 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.696 174.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.88 -39.66 90.07 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 120.714 0.292 . . . . 0.0 110.951 -176.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.2 mttt -65.22 -45.24 85.5 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 123.373 0.669 . . . . 0.0 111.552 177.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.9 pttp -65.72 -39.25 90.98 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.152 0.501 . . . . 0.0 109.726 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 54' ' ' MET . 53.5 t -67.09 -52.39 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.807 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -55.59 -50.11 70.97 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 124.122 0.889 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.06 -40.7 97.42 Favored Glycine 0 CA--C 1.507 -0.461 0 O-C-N 123.607 0.567 . . . . 0.0 112.642 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.39 -54.26 48.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.031 0.443 . . . . 0.0 110.187 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.577 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.6 ptp -70.26 -30.51 67.56 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.28 -40.97 97.05 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.74 -24.97 44.53 Favored 'General case' 0 C--N 1.313 -1.003 0 O-C-N 121.149 -0.969 . . . . 0.0 112.067 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.472 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 50.0 m -86.67 -18.8 30.37 Favored 'General case' 0 C--N 1.277 -2.561 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -175.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.25 160.14 14.82 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -98.59 -2.66 38.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.689 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.521 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 81.2 p -158.64 161.67 37.2 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.41 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -70.48 -29.74 66.36 Favored 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.915 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.77 -41.57 83.08 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 7.6 tp10 -62.97 -49.53 74.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 176.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -43.64 98.25 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.782 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.506 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -54.21 -48.88 70.55 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 172.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.0 -55.8 16.87 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.787 -172.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 54' ' ' MET . 2.1 pp -65.62 -30.16 70.84 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.538 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.92 -39.26 56.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 177.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.66 -32.94 73.14 Favored 'General case' 0 C--N 1.351 0.639 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.9 mm-40 -65.56 -47.08 77.05 Favored 'General case' 0 C--O 1.249 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 111.705 174.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -36.3 66.78 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.039 -1.064 . . . . 0.0 112.048 -177.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.8 tt -65.35 -37.8 80.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.785 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.5 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 12.5 t80 -54.25 -54.02 45.77 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 124.599 1.16 . . . . 0.0 111.907 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -65.41 -32.94 74.83 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.848 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.6 -41.02 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 51.5 mt-30 -64.27 -48.26 76.4 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.537 0.684 . . . . 0.0 110.622 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.84 -26.55 59.78 Favored 'General case' 0 N--CA 1.398 -3.057 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.6 tt0 -61.51 -48.63 80.17 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.737 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -66.51 -38.2 86.69 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.926 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -64.11 -47.85 78.4 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -63.48 -41.06 98.58 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 118.268 0.485 . . . . 0.0 111.543 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.443 -0.777 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.434 -178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.648 ' HA ' ' OD2' ' B' ' 113' ' ' ASP . 7.6 t . . . . . 0 C--O 1.218 -0.599 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.79 -35.53 81.38 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.256 175.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -64.55 -40.16 95.07 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . 0.648 ' OD2' ' HA ' ' B' ' 110' ' ' THR . 38.2 m-20 -54.17 -48.51 70.85 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.39 0.431 . . . . 0.0 110.417 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.78 -46.12 88.26 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.802 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -57.71 -63.45 1.24 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.835 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.506 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 14.9 t -60.17 -39.29 85.9 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.7 t -71.74 -47.54 53.1 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.074 -174.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 15.9 m-20 -71.73 -54.2 11.05 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.72 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 C--N 1.317 -0.834 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -171.365 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.737 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 21.3 ttt . . . . . 0 N--CA 1.441 -0.886 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.55 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 42.9 mt-10 -57.71 -26.74 62.19 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 26.0 m -66.88 -49.11 66.68 Favored 'General case' 0 C--O 1.26 1.614 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.975 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.9 pp -71.12 -28.06 31.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.834 0.826 . . . . 0.0 110.183 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.56 ' CG2' HD11 ' A' ' 26' ' ' ILE . 12.1 mm -67.79 -44.48 85.58 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.252 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.138 174.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -60.62 -39.1 86.97 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 22.9 t -61.24 -50.63 72.28 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.66 -53.16 61.24 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.454 1.101 . . . . 0.0 112.588 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.502 HD12 ' N ' ' B' ' 150' ' ' MET . 3.7 pp -72.71 -31.18 64.8 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -173.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . 0.502 ' N ' HD12 ' B' ' 149' ' ' LEU . 49.5 tpp . . . . . 0 C--N 1.315 -0.899 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.454 -174.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.37 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.489 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 62.4 p-90 -63.98 -17.84 63.68 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -69.35 -13.47 62.39 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.876 -177.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -89.61 -2.98 58.48 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.485 0.659 . . . . 0.0 109.788 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -95.62 -13.17 24.56 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.528 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.71 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -104.77 110.77 31.79 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.722 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.8 m -73.3 149.61 42.55 Favored 'General case' 0 C--N 1.279 -2.459 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -38.48 72.08 Favored 'General case' 0 C--O 1.209 -1.049 0 O-C-N 123.556 0.535 . . . . 0.0 109.654 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.89 -29.02 68.02 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.64 -52.97 9.33 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.2 ptm180 -58.66 -41.79 86.92 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.178 176.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.5 t -69.21 -25.4 64.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.442 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 15.2 t60 -67.98 -38.95 83.31 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.432 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -67.8 -37.72 82.38 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.811 177.281 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.2 t -57.04 -47.87 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-O 121.548 0.69 . . . . 0.0 109.384 174.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.2 t-80 -53.93 -50.66 65.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.503 176.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' B' ' 115' ' ' LEU . 54.8 mttm -64.6 -37.11 86.45 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.6 mt -55.58 -43.92 76.4 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.342 0.401 . . . . 0.0 109.941 176.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' HB3' ' A' ' 43' ' ' LEU . 2.3 t -60.08 -53.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 123.684 0.615 . . . . 0.0 111.905 175.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -65.48 -27.53 68.56 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.817 0.341 . . . . 0.0 111.624 -176.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.33 -43.2 19.41 Favored 'General case' 0 N--CA 1.424 -1.765 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.947 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.588 HD11 HG23 ' B' ' 145' ' ' ILE . 1.8 tt -70.22 -39.93 77.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.405 0 CA-C-O 121.606 0.717 . . . . 0.0 109.66 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.44 ' CD2' ' HD3' ' A' ' 39' ' ' ARG . 4.4 m-85 -125.66 102.29 29.28 Favored Pre-proline 0 N--CA 1.401 -2.887 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.759 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 51.1 Cg_exo -48.86 140.89 22.59 Favored 'Trans proline' 0 N--CA 1.438 -1.766 0 C-N-CA 123.294 2.663 . . . . 0.0 111.347 175.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.45 109.92 63.49 Favored Pre-proline 0 N--CA 1.382 -3.847 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.481 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.07 -26.92 4.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 121.92 1.747 . . . . 0.0 110.622 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -156.42 143.23 13.46 Favored Pre-proline 0 N--CA 1.433 -1.322 0 N-CA-C 106.22 -1.77 . . . . 0.0 106.22 -176.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.91 -21.82 42.87 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.612 2.208 . . . . 0.0 113.761 176.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -18.02 63.64 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.561 -0.712 . . . . 0.0 112.306 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.3 -14.76 63.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.652 0.739 . . . . 0.0 110.173 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.485 ' O ' ' HG2' ' A' ' 40' ' ' MET . 13.2 mt -91.32 1.78 56.86 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.569 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -133.16 14.91 4.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 122.076 0.941 . . . . 0.0 109.677 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 21.3 t70 -79.38 174.29 11.72 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.302 179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -25.89 63.01 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.543 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.44 ' HD3' ' CD2' ' A' ' 27' ' ' PHE . 23.9 ttm180 -61.03 -27.87 68.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.624 175.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.527 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 11.1 tpp -62.75 -42.49 99.7 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.773 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.54 -33.31 72.49 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 119.589 -0.844 . . . . 0.0 109.689 -176.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -71.97 -45.54 60.63 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.454 1.101 . . . . 0.0 110.479 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.485 ' HB3' HG22 ' A' ' 23' ' ' VAL . 95.5 mt -67.31 -45.32 76.81 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.327 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.513 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -72.83 -32.19 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 C-N-CA 120.534 -0.467 . . . . 0.0 110.239 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.89 -43.67 98.37 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.2 t80 -61.47 -51.45 68.61 Favored 'General case' 0 C--O 1.208 -1.085 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.975 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.24 87.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.629 0.252 . . . . 0.0 111.334 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -64.8 -42.64 94.88 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.4 pttp -70.5 -35.59 73.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.272 0.558 . . . . 0.0 110.208 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 46' ' ' TYR . 54.6 t -65.32 -49.68 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.162 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -55.43 -51.9 65.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.271 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.34 -38.85 91.66 Favored Glycine 0 C--N 1.333 0.393 0 O-C-N 123.642 0.589 . . . . 0.0 112.975 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.14 -54.12 45.68 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.254 0.55 . . . . 0.0 111.054 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 1.2 ptp -69.49 -27.82 65.53 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -62.47 -54.14 44.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.92 -17.81 60.5 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.184 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.0 t -79.72 -19.64 48.36 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 120.741 0.305 . . . . 0.0 110.96 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.48 165.25 12.09 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -175.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.43 6.12 37.46 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.284 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.489 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 7.2 t -173.59 162.66 4.21 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.71 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.95 -30.37 71.35 Favored 'General case' 0 C--O 1.168 -3.197 0 O-C-N 123.804 0.69 . . . . 0.0 110.77 178.18 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.12 -47.39 78.21 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.891 0.853 . . . . 0.0 109.543 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -71.6 -43.8 65.58 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.494 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.402 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.62 -40.12 94.93 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.646 ' CE1' HD13 ' B' ' 115' ' ' LEU . 5.1 t80 -60.6 -47.05 87.93 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.207 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.65 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 40.5 t-80 -63.35 -53.76 47.5 Favored 'General case' 0 C--O 1.205 -1.253 0 O-C-N 123.716 0.635 . . . . 0.0 111.524 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.5 pp -67.87 -30.47 69.84 Favored 'General case' 0 C--O 1.256 1.43 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.167 -174.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.432 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.23 -44.05 63.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 174.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -52.95 -33.0 48.91 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.394 0.678 . . . . 0.0 111.717 173.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 31.3 mt-10 -73.38 -44.63 58.17 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.549 0.214 . . . . 0.0 110.845 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.12 -37.74 78.49 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 118.687 -1.205 . . . . 0.0 110.509 -179.432 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.633 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -36.77 77.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.8 -54.29 36.19 Favored 'General case' 0 C--O 1.258 1.527 0 C-N-CA 124.505 1.122 . . . . 0.0 110.379 174.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.36 -31.82 70.49 Favored 'General case' 0 C--O 1.204 -1.334 0 O-C-N 123.8 0.688 . . . . 0.0 110.771 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.539 ' HA ' ' HE1' ' B' ' 141' ' ' MET . 1.3 mp -63.15 -46.93 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 O-C-N 123.389 0.431 . . . . 0.0 109.955 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 52.5 mt-30 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.699 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.578 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -74.07 -28.22 61.28 Favored 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.421 -176.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -62.49 -52.79 62.1 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.656 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -62.03 -44.54 96.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.927 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.3 OUTLIER -62.63 -53.63 51.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.698 -178.099 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.3 pt-20 -76.35 -34.77 58.95 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.88 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.029 -178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.435 -1.186 0 CA-C-O 121.244 0.545 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.54 -40.45 85.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.866 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . 0.482 ' HA ' HD12 ' B' ' 115' ' ' LEU . 25.0 mt-30 -64.52 -39.32 93.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.575 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.92 -50.96 68.79 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.647 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -42.23 90.94 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 123.166 0.291 . . . . 0.0 111.386 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.646 HD13 ' CE1' ' A' ' 65' ' ' TYR . 16.7 mt -51.44 -63.04 1.26 Allowed 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.643 0.59 . . . . 0.0 110.58 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 12.9 m -65.96 -28.48 68.93 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.495 -1.229 . . . . 0.0 112.298 -172.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.0 m -68.3 -40.66 81.66 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 120.631 -0.428 . . . . 0.0 109.957 176.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -76.15 -47.85 22.76 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.659 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 60.7 p . . . . . 0 C--N 1.321 -0.66 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.235 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.656 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.8 ttt . . . . . 0 N--CA 1.436 -1.155 0 CA-C-O 121.436 0.636 . . . . 0.0 111.436 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 13.4 tm-20 -56.55 -27.01 56.61 Favored 'General case' 0 C--O 1.2 -1.546 0 C-N-CA 124.096 0.958 . . . . 0.0 112.422 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 21.7 t -62.27 -49.95 73.65 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-N 117.97 0.35 . . . . 0.0 110.755 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.44 HD11 ' CG ' ' B' ' 141' ' ' MET 0.261 2.7 pp -70.29 -24.88 26.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.201 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.905 176.364 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.588 HG23 HD11 ' A' ' 26' ' ' ILE . 16.9 mm -63.13 -43.16 98.74 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.398 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 78.0 mtp180 -56.84 -45.1 82.59 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.304 0.641 . . . . 0.0 110.625 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 6.1 p -60.11 -36.64 77.91 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 119.542 -0.863 . . . . 0.0 113.255 176.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -76.11 -44.95 36.16 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.231 -0.988 . . . . 0.0 112.295 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.445 HD12 ' N ' ' B' ' 150' ' ' MET 0.262 3.1 pp -70.24 -33.55 71.78 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.211 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . 0.445 ' N ' HD12 ' B' ' 149' ' ' LEU . 50.5 ttm . . . . . 0 C--N 1.321 -0.657 0 CA-C-O 121.242 0.544 . . . . 0.0 111.039 -178.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.506 0 N-CA-C 116.156 1.223 . . . . 0.0 116.156 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -76.01 -2.14 29.15 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 117.48 0.64 . . . . 0.0 112.087 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -62.53 -21.33 65.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.449 0.642 . . . . 0.0 110.793 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -86.2 -10.55 54.49 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.809 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -102.85 5.21 38.47 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.867 0.841 . . . . 0.0 110.09 -177.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.3 p -129.31 110.79 21.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.5 m -83.22 151.04 25.84 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.456 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.8 56.98 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.934 0.894 . . . . 0.0 111.33 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -69.73 -30.05 67.56 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.409 HD12 HG23 ' A' ' 10' ' ' VAL . 2.9 tm? -74.76 -47.69 29.71 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 -177.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.538 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -64.93 -41.25 95.7 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.621 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 t -69.6 -25.35 63.92 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.596 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 15.6 t60 -75.31 -36.86 61.04 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.888 177.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 HD21 ' A' ' 68' ' ' LEU . 1.4 mp -63.29 -37.63 87.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 173.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 15' ' ' ARG . 99.5 t -60.21 -45.78 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 19.4 t-80 -55.77 -47.04 77.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.881 177.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -66.49 -39.21 88.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.78 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 26' ' ' ILE . 28.8 mt -53.47 -48.35 68.94 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 123.547 0.529 . . . . 0.0 109.799 173.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.431 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.8 t -54.67 -48.64 71.72 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 O-C-N 124.237 0.96 . . . . 0.0 111.612 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -69.37 -24.19 63.85 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -44.55 16.24 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.503 175.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.679 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.09 -29.61 37.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.958 0.885 . . . . 0.0 109.517 -177.743 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -123.46 84.62 52.65 Favored Pre-proline 0 N--CA 1.403 -2.822 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.899 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.87 115.95 2.68 Favored 'Trans proline' 0 N--CA 1.443 -1.468 0 C-N-CA 122.396 2.064 . . . . 0.0 109.072 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.47 118.05 67.92 Favored Pre-proline 0 N--CA 1.394 -3.225 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -168.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -78.92 -25.31 6.28 Favored 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 121.698 1.599 . . . . 0.0 109.537 172.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -167.42 145.43 4.0 Favored Pre-proline 0 CA--C 1.506 -0.731 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.23 -22.95 74.97 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.851 2.367 . . . . 0.0 114.167 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.19 -5.91 53.24 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.029 -1.044 . . . . 0.0 111.778 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.42 -8.36 59.05 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 40' ' ' MET . 28.6 mt -89.55 7.09 38.07 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.55 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.68 22.12 4.27 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.197 0.998 . . . . 0.0 108.944 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.597 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.3 t70 -95.61 172.68 7.91 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.058 -176.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -68.12 -22.84 64.86 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 122.794 0.437 . . . . 0.0 111.476 -178.438 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -79.05 -17.16 55.73 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.713 0.768 . . . . 0.0 109.416 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.597 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.3 tpp -62.98 -43.14 99.6 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.124 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -56.04 -38.84 71.12 Favored 'General case' 0 C--O 1.193 -1.873 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.082 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.407 HD21 HD22 ' B' ' 149' ' ' LEU . 2.8 t30 -68.09 -45.0 74.99 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.782 0.833 . . . . 0.0 111.546 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 37.4 mt -67.89 -43.44 79.31 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.184 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 p -73.25 -33.22 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.263 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.07 -44.05 97.51 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.517 0.675 . . . . 0.0 109.392 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.679 ' CE1' HG13 ' A' ' 26' ' ' ILE . 3.9 t80 -61.0 -47.19 87.59 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.263 174.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.13 97.32 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.501 -177.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -63.03 -46.3 88.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.898 176.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 19.7 pttp -64.06 -39.13 93.4 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 121.021 0.439 . . . . 0.0 110.528 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.58 -50.39 66.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.134 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -57.01 -47.79 80.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.719 0.807 . . . . 0.0 109.896 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -42.83 93.66 Favored Glycine 0 N--CA 1.446 -0.682 0 O-C-N 123.666 0.603 . . . . 0.0 112.632 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.35 -54.11 50.53 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.368 0.604 . . . . 0.0 110.564 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.521 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 ptp -67.16 -33.14 74.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.61 -50.96 71.86 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.01 -18.01 60.91 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.842 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -75.58 -54.52 6.87 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 122.374 0.269 . . . . 0.0 111.446 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.53 168.32 7.58 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.19 9.29 15.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.027 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.453 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 73.2 m -161.15 153.81 20.66 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 175.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.539 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.39 -39.58 74.46 Favored 'General case' 0 C--O 1.182 -2.472 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.461 -177.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.453 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 2.8 p-10 -62.78 -32.47 73.64 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 124.545 1.138 . . . . 0.0 109.479 176.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -71.96 -46.72 56.4 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.156 174.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.45 99.17 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.58 -49.06 77.63 Favored 'General case' 0 C--O 1.196 -1.731 0 C-N-CA 125.235 1.414 . . . . 0.0 109.381 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -66.12 -48.39 71.0 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 122.535 0.334 . . . . 0.0 111.669 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.444 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.8 pp -69.35 -29.96 67.88 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.642 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.548 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.93 -37.41 58.75 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.578 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.04 -35.93 80.09 Favored 'General case' 0 C--O 1.204 -1.317 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 7.2 mm-40 -59.89 -52.04 67.13 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.803 0.841 . . . . 0.0 110.263 172.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.73 -47.74 84.46 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.398 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.618 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.3 tt -68.16 -37.23 77.8 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.157 -177.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 13.0 t80 -56.88 -54.11 50.28 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 125.269 1.428 . . . . 0.0 111.395 176.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.4 ptpt -66.23 -32.28 73.61 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.411 -177.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.46 -39.54 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.684 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.0 mt-30 -66.2 -46.45 77.25 Favored 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.922 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.642 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.1 ptpt -75.2 -27.99 59.82 Favored 'General case' 0 N--CA 1.401 -2.92 0 C-N-CA 119.41 -0.916 . . . . 0.0 112.369 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 10.5 tp10 -57.54 -52.89 63.57 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.525 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -66.59 -41.55 88.33 Favored 'General case' 0 C--O 1.25 1.101 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.77 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' N ' HD12 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -60.77 -53.8 52.92 Favored 'General case' 0 N--CA 1.416 -2.165 0 C-N-CA 123.251 0.62 . . . . 0.0 110.433 -177.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -73.35 -32.31 64.46 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -175.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.428 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.245 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.442 -0.852 0 CA-C-O 121.476 0.655 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.57 -45.94 56.77 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.845 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.48 -42.94 97.31 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.24 -47.6 79.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.426 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.98 -44.16 82.4 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.75 0.656 . . . . 0.0 109.624 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.48 -60.62 3.5 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.867 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 17.5 m -57.05 -48.79 77.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.86 0.362 . . . . 0.0 111.837 -173.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 m -69.94 -52.61 23.03 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.047 -174.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.18 -40.88 59.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.566 -174.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.596 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 33.1 t . . . . . 0 N--CA 1.464 0.262 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.525 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 14.5 tpt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.528 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.0 mt-10 -48.98 -26.86 2.76 Favored 'General case' 0 C--O 1.187 -2.234 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 177.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.4 m -62.04 -60.33 3.77 Favored 'General case' 0 C--O 1.27 2.134 0 CA-C-N 119.391 0.996 . . . . 0.0 111.249 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.522 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.7 pp -72.53 -25.53 22.95 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 CA-C-O 122.492 1.139 . . . . 0.0 110.532 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.595 ' CG2' HD11 ' A' ' 26' ' ' ILE . 5.9 mm -70.48 -37.58 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.093 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.431 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.489 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 32.3 ttm180 -64.32 -36.55 84.48 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 m -57.83 -49.02 78.08 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.186 173.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -68.62 -41.63 79.21 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.489 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -77.27 -20.41 55.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--N 1.321 -0.632 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.743 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.373 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -75.74 -18.56 59.52 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.389 19.6 p80 -72.32 -0.52 12.53 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -174.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -90.56 -6.32 54.85 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.152 0.501 . . . . 0.0 109.878 173.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -106.72 11.99 29.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.206 0.527 . . . . 0.0 112.136 -176.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.474 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.7 p -129.05 109.9 19.67 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 CA-C-O 122.119 0.961 . . . . 0.0 109.51 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.0 m -73.87 150.74 40.75 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.842 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -38.36 84.64 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -61.29 -37.25 82.5 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.592 176.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.435 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -73.35 -45.51 54.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -173.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.546 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -70.41 -43.35 70.16 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.199 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.4 t -65.77 -28.07 68.75 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -64.97 -48.22 74.78 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.466 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -60.56 -38.75 85.57 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.823 177.415 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.0 t -57.46 -47.34 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.121 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.552 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.2 t-80 -62.98 -38.65 92.0 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.798 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.9 -35.6 77.04 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 119.11 -1.036 . . . . 0.0 111.538 175.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.58 -42.29 78.42 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.5 t -58.59 -50.25 79.67 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.713 173.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.4 mt-30 -62.52 -30.49 71.33 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.856 0.36 . . . . 0.0 111.64 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.35 -43.42 21.17 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.494 HG13 HG12 ' B' ' 145' ' ' ILE . 3.1 tt -70.68 -32.96 51.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.953 0.882 . . . . 0.0 109.62 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.428 ' HE1' ' NH1' ' A' ' 39' ' ' ARG . 79.1 t80 -125.37 84.96 59.13 Favored Pre-proline 0 N--CA 1.407 -2.594 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.531 -176.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -59.66 85.38 0.07 OUTLIER 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 123.073 2.516 . . . . 0.0 108.804 168.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -63.75 140.61 97.85 Favored Pre-proline 0 N--CA 1.424 -1.744 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -170.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.4 -21.19 6.52 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.945 2.43 . . . . 0.0 111.532 174.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -153.68 135.16 8.75 Favored Pre-proline 0 CA--C 1.505 -0.759 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -53.47 -24.25 27.68 Favored 'Trans proline' 0 CA--C 1.558 1.713 0 C-N-CA 122.726 2.284 . . . . 0.0 113.812 175.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.15 -14.7 59.36 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.826 -0.546 . . . . 0.0 111.68 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.66 -10.95 59.87 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.934 0.873 . . . . 0.0 109.494 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.2 mt -85.32 3.01 41.66 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.371 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.76 15.18 4.36 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.762 0.792 . . . . 0.0 110.052 177.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 36.3 t70 -74.93 175.63 7.91 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.947 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.06 -21.66 62.22 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.477 0.656 . . . . 0.0 110.417 178.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.428 ' NH1' ' HE1' ' A' ' 27' ' ' PHE . 60.0 ttt180 -75.52 -16.0 60.33 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.567 0.699 . . . . 0.0 109.2 176.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.662 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.58 -40.9 93.26 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.456 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -58.48 -32.13 68.48 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.233 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -72.02 -49.67 34.93 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 124.27 1.028 . . . . 0.0 110.774 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.71 -43.32 84.65 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.867 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.662 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -73.36 -28.05 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.25 -49.93 75.09 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.428 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -57.83 -46.16 85.13 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.998 175.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.31 90.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.512 0.196 . . . . 0.0 111.456 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -63.17 -44.62 94.93 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.205 0.602 . . . . 0.0 112.182 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.1 pttp -68.22 -36.95 80.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.188 0.518 . . . . 0.0 110.111 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.2 t -66.99 -47.72 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.612 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -55.52 -49.79 71.7 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.655 0.782 . . . . 0.0 108.999 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.44 84.84 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.922 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.12 -54.69 22.39 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.617 -0.343 . . . . 0.0 110.728 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.462 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.8 OUTLIER -66.78 -27.53 67.66 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.449 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.33 -53.75 47.73 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -67.7 -34.31 76.62 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.35 0.595 . . . . 0.0 111.574 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 33.8 m -68.53 -24.51 64.66 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.31 161.25 14.76 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -107.5 5.4 27.11 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.65 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.8 p -163.98 157.53 18.59 Favored 'General case' 0 CA--C 1.477 -1.833 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.27 -28.55 63.19 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.126 -178.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -67.06 -40.11 87.03 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -64.17 -45.27 89.15 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.463 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -43.6 92.95 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.889 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.693 ' CE1' HD13 ' B' ' 115' ' ' LEU . 10.9 t80 -60.68 -47.43 86.29 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.505 1.122 . . . . 0.0 109.944 178.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -63.38 -50.58 69.33 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.3 pp -70.55 -30.23 66.9 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.653 -175.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.408 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.8 OUTLIER -70.51 -43.28 69.98 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.562 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -55.34 -41.23 72.21 Favored 'General case' 0 C--O 1.202 -1.418 0 O-C-N 123.795 0.684 . . . . 0.0 110.795 173.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -56.96 -49.66 75.0 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 123.399 0.679 . . . . 0.0 111.718 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -36.3 68.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.573 -177.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.562 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.7 tt -69.61 -35.69 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.4 t80 -56.65 -52.5 64.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.975 1.31 . . . . 0.0 110.593 175.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.02 -32.4 73.6 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.375 -177.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.37 -43.01 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 O-C-N 123.244 0.34 . . . . 0.0 110.743 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.9 mt-30 -63.06 -52.71 61.71 Favored 'General case' 0 CA--C 1.491 -1.311 0 O-C-N 123.757 0.661 . . . . 0.0 110.679 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.8 ptpt -72.39 -27.93 62.68 Favored 'General case' 0 N--CA 1.409 -2.493 0 C-N-CA 119.184 -1.006 . . . . 0.0 112.908 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 40.4 tp10 -57.48 -52.89 63.56 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.1 -43.18 75.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.591 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -61.63 -52.93 62.32 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.9 pt-20 -71.46 -32.67 68.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.411 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.198 0.523 . . . . 0.0 110.458 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.549 0.91 0 CA-C-O 120.818 0.342 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.41 -45.65 53.31 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.688 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -64.22 -40.81 96.81 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.096 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.36 -40.85 85.8 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.634 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 67.8 tp -56.28 -53.69 54.2 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.693 HD13 ' CE1' ' A' ' 65' ' ' TYR . 26.4 mt -51.59 -65.24 0.59 Allowed 'General case' 0 C--O 1.205 -1.261 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.274 176.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.7 m -59.37 -31.8 69.55 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.96 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 56.7 m -69.1 -47.89 63.99 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.124 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -76.5 -34.41 58.61 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.868 -176.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 66.7 p . . . . . 0 C--O 1.243 0.74 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -174.949 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.512 ' SD ' HD11 ' B' ' 144' ' ' ILE . 9.7 tpt . . . . . 0 CA--C 1.552 1.021 0 CA-C-O 121.472 0.654 . . . . 0.0 109.587 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.433 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 51.3 mt-10 -54.78 -25.82 30.57 Favored 'General case' 0 C--O 1.194 -1.823 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.5 p -63.57 -59.82 4.13 Favored 'General case' 0 C--O 1.265 1.914 0 CA-C-N 119.54 1.064 . . . . 0.0 110.859 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' B' ' 141' ' ' MET . 9.0 pt -61.92 -35.41 67.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.736 0.779 . . . . 0.0 109.911 176.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.494 HG12 HG13 ' A' ' 26' ' ' ILE . 1.4 mp -67.91 -34.29 66.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.069 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 146' ' ' ARG . 21.6 ttt180 -65.18 -47.53 76.64 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 8.8 p -63.53 -33.91 76.64 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.987 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -80.68 -35.64 33.39 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -74.49 -23.59 58.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.023 0.374 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 59.7 ttp . . . . . 0 N--CA 1.463 0.213 0 O-C-N 123.976 0.797 . . . . 0.0 109.605 176.849 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.536 0 N-CA-C 115.052 0.781 . . . . 0.0 115.052 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -73.27 -9.13 58.38 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 117.392 0.596 . . . . 0.0 111.309 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -57.62 -21.94 42.46 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 121.475 0.655 . . . . 0.0 112.099 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.8 -19.51 58.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.557 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.57 4.07 54.31 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.716 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -130.64 109.48 17.05 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 178.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 m -74.86 154.36 38.27 Favored 'General case' 0 N--CA 1.413 -2.279 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -38.37 56.91 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.718 0.636 . . . . 0.0 110.261 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.684 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 13.9 t70 -60.41 -44.04 96.11 Favored 'General case' 0 C--O 1.179 -2.64 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.684 177.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.561 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.1 tm? -67.68 -51.58 47.98 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -171.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.561 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -60.38 -45.73 92.49 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.071 177.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.2 t -68.02 -22.25 64.98 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.953 0.882 . . . . 0.0 109.584 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.711 ' NE2' ' HA ' ' B' ' 119' ' ' SER . 2.1 t60 -71.61 -43.03 66.93 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.836 -1.074 . . . . 0.0 108.434 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -68.56 -33.6 74.37 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.735 176.013 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 15' ' ' ARG . 92.9 t -56.37 -48.14 80.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 O-C-N 123.773 0.671 . . . . 0.0 109.656 176.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.469 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 18.4 t-80 -66.2 -36.92 84.31 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.594 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -66.56 -35.24 79.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.89 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.8 mt -56.23 -46.04 79.7 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 175.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.9 t -57.32 -50.91 75.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 O-C-N 124.052 0.845 . . . . 0.0 111.165 173.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 68.6 mt-30 -60.57 -32.66 71.74 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.477 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -78.33 -46.18 20.75 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.959 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.599 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -70.28 -35.21 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.868 0.842 . . . . 0.0 109.621 -177.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 2.0 m-85 -127.01 90.78 48.57 Favored Pre-proline 0 N--CA 1.402 -2.844 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.89 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 23.8 Cg_endo -64.98 95.14 0.24 Allowed 'Trans proline' 0 N--CA 1.443 -1.484 0 C-N-CA 121.788 1.659 . . . . 0.0 108.207 174.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.449 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 9.9 t -68.87 136.36 89.91 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.798 -170.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.82 -25.36 10.7 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.213 2.608 . . . . 0.0 111.482 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -149.15 144.49 18.07 Favored Pre-proline 0 CA--C 1.49 -1.361 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.41 -13.45 33.0 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.286 1.991 . . . . 0.0 112.575 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.99 -9.33 58.75 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.0 -0.438 . . . . 0.0 111.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.449 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -79.76 -12.24 59.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.884 0.85 . . . . 0.0 109.034 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.458 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.3 mt -85.36 5.98 28.43 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.944 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.03 20.66 4.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.626 0.727 . . . . 0.0 109.736 177.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.61 ' O ' ' HB3' ' A' ' 40' ' ' MET . 23.4 t70 -81.65 175.94 10.06 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.85 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.574 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -71.17 -29.82 65.66 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.891 -0.506 . . . . 0.0 111.252 174.256 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -66.16 -23.45 66.47 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.945 0.879 . . . . 0.0 109.158 177.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -60.38 -36.78 78.88 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.951 176.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.8 pt-20 -61.46 -37.29 83.05 Favored 'General case' 0 C--O 1.2 -1.542 0 C-N-CA 118.444 -1.302 . . . . 0.0 109.672 -178.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -70.7 -43.04 69.84 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.727 0.811 . . . . 0.0 111.17 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.28 -43.82 73.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.641 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.645 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.3 p -73.3 -30.83 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.11 87.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 175.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.542 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.4 t80 -59.41 -46.78 87.74 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.546 175.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.39 -44.9 93.4 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.182 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -64.11 -42.8 96.74 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 122.938 0.495 . . . . 0.0 111.869 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 35.9 pttt -67.98 -40.13 83.18 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 -178.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 54' ' ' MET . 37.7 t -64.15 -50.47 76.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.933 178.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -56.19 -48.5 76.27 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.983 0.802 . . . . 0.0 109.24 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.86 96.28 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.079 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -60.25 -54.31 47.23 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.403 0.62 . . . . 0.0 110.034 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.519 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.3 ptp -67.76 -31.21 70.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.24 -35.72 80.13 Favored 'General case' 0 C--O 1.202 -1.432 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -20.57 37.3 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 121.296 -0.877 . . . . 0.0 111.748 177.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.3 t -80.65 -49.01 11.8 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.54 164.49 13.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -102.57 -5.01 24.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.988 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.2 m -157.81 154.17 27.64 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -63.6 -33.55 75.86 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.493 178.363 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -56.31 -47.49 78.59 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.44 0.638 . . . . 0.0 109.536 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.71 -45.03 80.05 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.753 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -41.01 98.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.636 ' CE1' HD13 ' B' ' 115' ' ' LEU . 8.5 t80 -63.19 -48.47 78.21 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.336 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m80 -67.25 -44.8 78.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -70.27 -30.57 67.63 Favored 'General case' 0 C--O 1.254 1.341 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.157 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.27 -41.09 67.12 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -58.3 -35.09 71.32 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.616 0.767 . . . . 0.0 111.57 176.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 32.3 mm-40 -70.08 -42.86 72.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.055 0.455 . . . . 0.0 111.122 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.54 -39.51 70.64 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.723 -179.327 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.627 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -67.29 -34.64 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.509 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 2.7 t80 -53.75 -50.88 65.03 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 124.856 1.263 . . . . 0.0 110.756 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.0 ptpt -66.73 -33.66 76.13 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.5 0.5 . . . . 0.0 110.77 -176.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.31 -45.35 98.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.6 mt-30 -59.71 -46.52 88.85 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.777 -176.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -79.03 -27.01 43.16 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -59.97 -46.08 90.6 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.704 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.2 pp -68.81 -40.65 79.43 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.127 178.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 47.3 mt-10 -55.57 -52.75 62.7 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 121.11 0.481 . . . . 0.0 110.818 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.3 pt-20 -67.1 -39.38 86.7 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.206 -176.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.775 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.344 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.441 HG23 HD22 ' B' ' 111' ' ' LEU . 6.5 t . . . . . 0 N--CA 1.443 -0.804 0 CA-C-O 121.054 0.454 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . 0.441 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -71.13 -41.81 70.03 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -67.98 -40.92 83.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.33 -178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.84 -47.99 83.86 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.585 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 tt -55.54 -49.77 71.79 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.636 HD13 ' CE1' ' A' ' 65' ' ' TYR . 51.8 mt -55.89 -67.54 0.28 Allowed 'General case' 0 C--O 1.21 -1.025 0 O-C-N 124.287 0.992 . . . . 0.0 111.451 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 22.5 m -58.82 -38.33 78.42 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.694 -169.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.8 m -69.76 -51.77 31.15 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.047 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.54 -33.63 58.55 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.517 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.711 ' HA ' ' NE2' ' A' ' 17' ' ' HIS . 22.6 t . . . . . 0 C--O 1.246 0.894 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.704 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.0 ttt . . . . . 0 N--CA 1.446 -0.654 0 CA-C-O 120.383 0.135 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.584 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.9 mt-10 -54.48 -27.18 36.0 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -61.32 -51.0 70.66 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.013 0.435 . . . . 0.0 110.668 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -75.34 -24.35 17.38 Favored 'Isoleucine or valine' 0 C--O 1.249 1.049 0 CA-C-O 122.015 0.912 . . . . 0.0 110.764 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.599 ' CG2' HD11 ' A' ' 26' ' ' ILE . 16.1 mm -65.94 -42.24 91.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.776 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -60.37 -40.17 89.87 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 123.861 0.864 . . . . 0.0 108.906 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.2 m -56.12 -45.93 79.33 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 123.553 0.533 . . . . 0.0 110.017 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -71.02 -50.07 38.12 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.2 pp -71.69 -31.5 66.83 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -173.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . 0.454 ' N ' HD12 ' B' ' 149' ' ' LEU . 16.4 tpt . . . . . 0 C--N 1.309 -1.188 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.215 0 N-CA-C 115.679 1.032 . . . . 0.0 115.679 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -69.51 -11.27 60.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 117.601 0.701 . . . . 0.0 111.094 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -60.23 -23.03 63.73 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.936 0.398 . . . . 0.0 111.471 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -79.88 -6.55 57.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.3 0.572 . . . . 0.0 110.512 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -101.05 9.56 42.01 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.788 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.717 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -126.19 111.28 26.05 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.265 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 177.703 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -73.19 150.16 42.33 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.65 -37.99 59.54 Favored 'General case' 0 N--CA 1.441 -0.892 0 O-C-N 123.798 0.686 . . . . 0.0 110.075 176.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 12.4 m-20 -53.17 -44.75 68.11 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 175.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.596 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.57 -54.14 9.99 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 -170.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.1 ptm180 -59.79 -45.27 92.81 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 t -69.68 -25.56 63.95 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.484 0.659 . . . . 0.0 109.947 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.649 ' CE1' ' HA ' ' B' ' 119' ' ' SER . 19.5 t60 -65.92 -46.53 77.88 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.219 176.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -65.87 -34.5 78.29 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.259 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.4 t -55.35 -47.32 78.14 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 CA-C-O 121.33 0.586 . . . . 0.0 109.736 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.48 -37.37 82.8 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.145 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.597 ' HZ3' ' CE1' ' A' ' 17' ' ' HIS . 12.6 mptt -64.54 -37.62 88.18 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.802 175.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 94.1 mt -56.67 -45.08 81.91 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.402 HG11 ' HE3' ' A' ' 40' ' ' MET . 55.6 t -60.4 -53.84 43.26 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 O-C-N 123.508 0.505 . . . . 0.0 110.491 173.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -53.22 -34.72 58.27 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.607 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -79.32 -46.15 18.25 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.675 HD11 HG23 ' B' ' 145' ' ' ILE . 5.5 tt -71.07 -33.25 50.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.311 0.577 . . . . 0.0 110.708 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.418 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 82.6 t80 -124.25 95.4 43.63 Favored Pre-proline 0 N--CA 1.409 -2.516 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.808 -176.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 29.2 Cg_endo -62.37 109.56 0.88 Allowed 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.478 2.118 . . . . 0.0 110.414 173.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.46 HG21 HD21 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -72.82 119.58 76.15 Favored Pre-proline 0 N--CA 1.397 -3.091 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.278 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.6 -15.19 11.11 Favored 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 122.398 2.065 . . . . 0.0 110.844 176.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.13 143.31 4.4 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.483 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.9 Cg_endo -59.88 -21.0 62.41 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.251 1.967 . . . . 0.0 113.346 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.13 -10.91 60.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.49 -0.756 . . . . 0.0 111.393 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.8 -13.93 59.97 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.682 0.753 . . . . 0.0 110.054 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 32' ' ' PRO . 7.7 mt -88.41 5.34 42.72 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.172 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -133.66 20.42 3.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.892 0.854 . . . . 0.0 109.537 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.649 ' O ' ' HB3' ' A' ' 40' ' ' MET . 13.7 t70 -80.58 172.91 13.15 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.865 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.609 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -72.06 -26.48 62.2 Favored 'General case' 0 C--N 1.309 -1.172 0 O-C-N 121.592 -0.693 . . . . 0.0 110.455 175.259 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -67.57 -25.8 65.97 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.649 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 3.0 tpp -59.92 -41.14 91.08 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.902 -1.044 . . . . 0.0 112.248 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 9.7 pt-20 -64.94 -27.9 69.15 Favored 'General case' 0 C--O 1.206 -1.229 0 C-N-CA 118.648 -1.221 . . . . 0.0 109.916 -177.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -74.03 -45.08 51.97 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.117 0.967 . . . . 0.0 110.337 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.99 -41.38 77.92 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.711 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.551 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.7 p -73.49 -30.47 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.29 -44.13 95.65 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 7.0 t80 -60.02 -51.09 71.14 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.203 172.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.21 -43.33 87.61 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.021 0.439 . . . . 0.0 111.223 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -66.25 -46.74 76.05 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 123.571 0.749 . . . . 0.0 111.838 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 12.5 pttp -63.79 -37.0 85.73 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.506 ' O ' ' HG2' ' A' ' 54' ' ' MET . 21.8 t -69.2 -53.15 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.295 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 55' ' ' TYR . 13.5 tm-20 -54.35 -50.5 67.3 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 124.198 0.936 . . . . 0.0 109.718 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.07 99.43 Favored Glycine 0 C--O 1.222 -0.651 0 O-C-N 123.576 0.547 . . . . 0.0 112.441 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -59.38 -52.2 66.64 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.227 0.537 . . . . 0.0 111.374 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.533 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.5 ptp -71.45 -27.51 63.31 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 40.9 t80 -64.26 -47.45 79.56 Favored 'General case' 0 C--O 1.206 -1.215 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 176.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -71.89 -25.71 62.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.26 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.5 t -80.84 -24.92 38.1 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.18 168.97 12.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -109.58 4.72 22.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.653 178.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.8 p -168.95 153.47 5.7 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.717 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -64.74 -33.83 76.9 Favored 'General case' 0 C--O 1.189 -2.109 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.812 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.77 -27.25 63.78 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.276 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.539 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 6.5 tp10 -75.32 -44.68 44.08 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 173.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -39.38 93.62 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.764 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.721 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 5.2 t80 -65.3 -46.99 78.18 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.069 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -56.4 -57.42 12.38 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 124.2 1.0 . . . . 0.0 111.697 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.9 pp -69.15 -30.32 68.53 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.52 -39.56 64.7 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.69 -38.8 82.57 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.091 176.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.69 -44.07 94.77 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -36.85 72.76 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 119.327 -0.949 . . . . 0.0 111.361 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.596 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.2 tt -69.98 -39.35 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.1 t80 -52.19 -53.29 45.1 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.073 1.349 . . . . 0.0 111.067 174.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -66.33 -34.01 77.02 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.007 -176.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.68 -42.84 93.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 O-C-N 123.426 0.454 . . . . 0.0 111.221 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.607 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 47.9 mt-30 -61.21 -48.77 79.99 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 121.414 0.625 . . . . 0.0 110.345 -178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.7 ptpt -74.93 -27.7 60.31 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.506 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -61.31 -47.78 84.4 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.41 ' HB3' ' HG3' ' B' ' 141' ' ' MET . 4.4 pp -69.78 -36.91 76.13 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.465 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.7 OUTLIER -61.72 -53.36 57.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.199 0.6 . . . . 0.0 110.96 179.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -73.01 -37.38 66.97 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -176.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.589 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.215 -175.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.422 -1.871 0 CA-C-O 120.357 0.122 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.83 -57.81 11.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.614 0.571 . . . . 0.0 112.237 -178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -69.19 -36.67 77.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.611 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -64.71 -47.9 76.63 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.261 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.02 -47.59 85.21 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.439 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.721 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 18.3 mt -51.57 -66.41 0.39 Allowed 'General case' 0 C--O 1.214 -0.771 0 O-C-N 124.131 0.895 . . . . 0.0 111.738 177.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 15.0 t -62.56 -35.54 79.81 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -169.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -76.57 -44.35 35.04 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.304 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -76.14 -27.79 57.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.077 0.465 . . . . 0.0 110.642 -175.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.649 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 19.8 t . . . . . 0 C--N 1.313 -1.009 0 C-N-CA 120.498 -0.481 . . . . 0.0 112.064 -179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.429 ' O ' HG12 ' B' ' 145' ' ' ILE . 92.1 mmm . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.673 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 44.9 mt-10 -47.63 -29.85 3.26 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -173.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 35.0 t -59.3 -59.6 5.2 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 120.878 0.37 . . . . 0.0 110.299 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -70.54 -24.32 25.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.615 0.722 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 26' ' ' ILE . 13.3 mm -66.45 -49.95 71.19 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.604 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 19.1 mtp180 -66.25 -34.89 79.04 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 120.48 0.181 . . . . 0.0 110.902 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 t -57.22 -43.02 82.43 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 123.935 0.772 . . . . 0.0 109.111 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -77.1 -54.92 5.92 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.188 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.616 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.3 pp -65.17 -26.64 68.25 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 -172.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . 0.4 ' N ' HD12 ' B' ' 149' ' ' LEU . 15.6 tpt . . . . . 0 C--N 1.308 -1.238 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.379 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.456 0 N-CA-C 115.107 0.803 . . . . 0.0 115.107 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.3 p-90 -67.48 -7.29 24.41 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -55.84 -30.36 61.33 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.024 0.44 . . . . 0.0 111.354 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -75.84 -10.46 59.45 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.046 0.45 . . . . 0.0 111.173 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -106.78 11.98 29.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.205 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.508 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.3 p -128.38 112.2 26.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 121.753 0.787 . . . . 0.0 109.685 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -74.62 150.07 39.78 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.963 -175.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.435 HE21 ' N ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -59.24 -41.98 90.01 Favored 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 175.533 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.435 ' N ' HE21 ' A' ' 12' ' ' GLN . 8.2 m-20 -65.02 -29.4 70.31 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.384 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -74.41 -52.34 12.37 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 -177.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.3 ptm180 -65.87 -42.29 90.56 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.57 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -69.68 -25.83 64.08 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CD2' ' HB3' ' B' ' 119' ' ' SER . 73.0 t60 -66.73 -45.31 79.07 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 121.41 0.624 . . . . 0.0 109.599 175.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.704 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -62.7 -36.8 84.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.232 177.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -60.78 -48.75 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.318 0.647 . . . . 0.0 109.65 173.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.487 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 33.0 t-80 -55.12 -45.18 75.54 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.32 0.648 . . . . 0.0 110.767 177.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -66.39 -37.87 86.22 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.871 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.98 -43.16 86.39 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 18.6 t -54.55 -49.64 64.91 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 C-N-CA 123.964 0.906 . . . . 0.0 111.0 173.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.95 -15.93 61.1 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.655 -0.818 . . . . 0.0 113.112 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.08 -45.67 16.14 Favored 'General case' 0 C--O 1.208 -1.107 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.46 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.563 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.8 tt -70.53 -30.47 42.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 122.417 1.103 . . . . 0.0 109.885 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -134.85 83.37 41.13 Favored Pre-proline 0 N--CA 1.399 -3.007 0 CA-C-N 114.192 -1.367 . . . . 0.0 107.872 -176.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.78 94.0 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.381 2.054 . . . . 0.0 108.284 170.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 t -63.78 126.99 91.0 Favored Pre-proline 0 N--CA 1.414 -2.263 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.862 -169.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -72.75 -26.4 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.78 2.32 . . . . 0.0 111.298 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.4 142.47 14.62 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.88 -25.14 34.11 Favored 'Trans proline' 0 CA--C 1.554 1.485 0 C-N-CA 122.562 2.175 . . . . 0.0 114.559 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.64 -10.81 59.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.258 -0.902 . . . . 0.0 111.82 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.55 59.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.577 0.703 . . . . 0.0 109.914 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.438 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -87.5 0.38 55.64 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.089 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.86 34.37 3.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 122.002 0.906 . . . . 0.0 110.681 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.662 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.0 t70 -95.32 177.25 5.91 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.454 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.662 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.01 -25.67 62.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 121.723 -0.611 . . . . 0.0 109.778 176.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.5 ttm180 -66.24 -24.57 66.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.556 175.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.583 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 6.1 tpp -60.57 -43.74 96.95 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.54 -0.754 . . . . 0.0 112.38 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HA ' HG12 ' A' ' 44' ' ' VAL . 11.3 pt-20 -67.56 -26.43 66.3 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 118.603 -1.239 . . . . 0.0 110.297 -177.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -73.1 -44.89 59.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.744 177.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 77.6 mt -69.78 -41.03 75.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.578 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 41' ' ' GLU . 3.6 p -71.77 -28.18 29.98 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.668 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.2 87.04 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.273 0.559 . . . . 0.0 109.545 175.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.0 t80 -60.95 -45.87 92.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.294 174.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.84 97.92 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.418 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -62.56 -45.62 92.11 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.571 0.749 . . . . 0.0 112.225 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 12.7 pttp -63.91 -37.39 87.21 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.354 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 51.0 t -72.22 -47.71 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.321 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.74 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.12 -45.24 91.41 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.004 0.922 . . . . 0.0 109.863 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.88 -42.15 99.71 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.937 177.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.97 -54.11 50.59 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.376 0.27 . . . . 0.0 111.32 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.462 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -67.23 -30.98 71.03 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.401 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -59.31 -49.59 77.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -77.34 -21.67 53.01 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.324 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -80.97 -35.9 31.54 Favored 'General case' 0 CA--C 1.553 1.075 0 CA-C-O 120.609 0.242 . . . . 0.0 111.498 -178.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.58 167.84 16.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.133 0.492 . . . . 0.0 111.499 -178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -121.83 15.1 10.9 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.639 0.733 . . . . 0.0 110.503 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.5 m -156.0 148.92 24.2 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.508 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -68.04 -39.75 83.0 Favored 'General case' 0 C--O 1.191 -1.997 0 CA-C-O 121.034 0.445 . . . . 0.0 111.542 -179.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -67.71 -32.87 73.81 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 123.627 0.771 . . . . 0.0 108.982 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.56 -48.05 70.89 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.617 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -41.28 98.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.565 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -49.26 77.91 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.819 1.248 . . . . 0.0 109.764 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 32.6 m170 -64.1 -49.03 73.85 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.419 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.2 pp -69.62 -30.45 68.18 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.75 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.704 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -74.56 -35.99 63.08 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.524 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.62 -31.79 73.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.1 mm-40 -71.57 -43.2 66.75 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.035 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -71.41 -36.29 71.29 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.331 -179.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.592 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.4 tt -67.23 -39.78 83.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.5 t80 -55.24 -54.66 40.61 Favored 'General case' 0 C--O 1.262 1.716 0 C-N-CA 124.491 1.116 . . . . 0.0 111.291 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 18.1 ptpt -64.42 -34.67 78.73 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.229 -177.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.14 -40.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 O-C-N 123.395 0.434 . . . . 0.0 111.187 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.1 mt-30 -65.76 -52.49 50.57 Favored 'General case' 0 CA--C 1.489 -1.375 0 CA-C-O 121.504 0.669 . . . . 0.0 110.471 -177.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -72.18 -27.93 62.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.31 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -61.62 -51.97 66.3 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 123.635 0.584 . . . . 0.0 109.631 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -62.39 -40.31 96.07 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.489 -178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.412 ' N ' HD12 ' A' ' 79' ' ' LEU . 3.4 tm-20 -62.62 -49.74 73.98 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 123.366 0.666 . . . . 0.0 110.468 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -75.01 -35.49 61.97 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.786 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.572 177.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.431 HG23 HD22 ' B' ' 111' ' ' LEU . 5.1 t . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . 0.431 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -73.35 -46.48 48.92 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.226 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -59.22 -42.24 90.53 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 120.967 0.413 . . . . 0.0 110.596 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.48 -43.59 89.75 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.851 176.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -55.96 -49.44 73.53 Favored 'General case' 0 C--O 1.264 1.823 0 CA-C-O 121.42 0.628 . . . . 0.0 109.868 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.423 HD23 ' O ' ' B' ' 111' ' ' LEU . 4.1 mm? -53.51 -54.61 34.79 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.302 176.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 33.6 m -60.85 -43.16 98.7 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.273 0.983 . . . . 0.0 110.481 -176.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 40.2 t -58.45 -49.55 76.93 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.414 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -77.13 -52.48 9.2 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 117.679 -1.608 . . . . 0.0 112.828 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.498 ' HB3' ' CD2' ' A' ' 17' ' ' HIS . 77.6 p . . . . . 0 C--N 1.318 -0.795 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.462 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.0 ttt . . . . . 0 N--CA 1.442 -0.86 0 CA-C-O 120.898 0.38 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.635 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.282 21.0 mt-10 -49.57 -28.03 5.16 Favored 'General case' 0 C--O 1.187 -2.229 0 N-CA-C 116.574 2.064 . . . . 0.0 116.574 -176.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 p -54.79 -60.04 3.91 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 119.167 0.894 . . . . 0.0 111.274 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.429 HD11 ' HG3' ' B' ' 141' ' ' MET . 22.1 pt -68.99 -25.47 30.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.753 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.635 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 17.4 mm -70.87 -40.52 76.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.196 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.747 177.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 24.5 mmm180 -60.83 -47.8 84.7 Favored 'General case' 0 CA--C 1.498 -1.019 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.4 p -60.11 -38.25 82.42 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 119.564 -0.854 . . . . 0.0 111.747 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.599 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 55.2 mm-40 -66.17 -57.56 7.36 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 175.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.479 HD23 HG22 ' B' ' 145' ' ' ILE . 4.3 pp -61.48 -23.75 66.1 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -173.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . 0.407 ' HG3' HD12 ' B' ' 149' ' ' LEU . 70.0 mtm . . . . . 0 C--O 1.239 0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.796 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . . . . . . 0 CA--C 1.524 0.647 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.499 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 65.8 p-90 -71.31 -5.68 34.16 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.574 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 25.4 p80 -70.51 -11.89 61.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.91 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 13.1 pt-20 -90.71 -6.83 53.96 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.989 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.499 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 17.7 m-70 -95.08 5.88 50.62 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.408 0.683 . . . . 0.0 110.044 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.4 p -133.07 121.46 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 m -77.91 149.88 34.15 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -36.1 79.79 Favored 'General case' 0 C--O 1.205 -1.242 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 9.6 m-20 -66.02 -29.26 69.6 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.2 tm? -73.22 -51.55 17.29 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -177.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.518 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.3 ptm180 -65.14 -43.07 93.05 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.106 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.43 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 38.9 t -64.68 -28.83 69.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 121.464 0.649 . . . . 0.0 109.288 178.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -67.23 -43.86 80.93 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.637 176.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.501 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -63.46 -37.45 87.33 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.313 176.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 15' ' ' ARG . 89.7 t -55.03 -47.05 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.423 0.689 . . . . 0.0 109.595 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.462 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 13.2 t-80 -63.31 -37.05 85.75 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.313 178.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.66 -32.65 66.0 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 118.891 -1.124 . . . . 0.0 111.783 176.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.4 mt -57.06 -43.68 82.27 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 173.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 23.4 t -57.63 -46.79 86.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.1 172.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 34.6 mt-30 -69.96 -31.16 68.73 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.529 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -73.36 -45.9 52.31 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.441 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.3 tt -70.85 -33.74 53.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.393 0.616 . . . . 0.0 110.781 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -127.02 81.74 69.35 Favored Pre-proline 0 N--CA 1.418 -2.074 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.717 -174.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.57 120.15 7.36 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.346 2.697 . . . . 0.0 109.358 169.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.5 112.72 4.54 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 -170.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.38 -12.42 9.12 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 121.82 1.68 . . . . 0.0 108.498 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -176.83 137.56 0.43 Allowed Pre-proline 0 CA--C 1.496 -1.126 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.93 -22.19 73.66 Favored 'Trans proline' 0 N--CA 1.45 -1.061 0 C-N-CA 121.989 1.793 . . . . 0.0 112.158 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.88 -3.47 57.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.914 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.07 -10.72 59.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.107 0.956 . . . . 0.0 108.453 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.84 5.4 25.28 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.627 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.6 16.92 3.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.638 0.733 . . . . 0.0 110.351 175.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.0 t70 -83.19 179.1 7.82 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.806 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -69.86 -26.76 64.36 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.51 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 12.1 ttm180 -68.03 -21.01 65.04 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 9.0 tpp -63.44 -44.01 95.77 Favored 'General case' 0 C--O 1.206 -1.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.315 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.1 pt-20 -62.62 -30.02 71.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 119.347 -0.941 . . . . 0.0 109.73 -177.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.429 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.9 t30 -71.41 -47.65 54.69 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 124.57 1.148 . . . . 0.0 110.309 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 82.5 mt -69.11 -41.8 76.93 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.391 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.509 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -73.32 -27.82 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.78 77.12 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.581 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 3.1 t80 -56.23 -42.41 77.25 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.108 0.563 . . . . 0.0 109.889 173.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.84 -42.52 85.61 Favored 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.083 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -64.44 -42.48 95.97 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.508 0.323 . . . . 0.0 111.638 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.581 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 5.1 ptmt -63.02 -44.81 94.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.244 176.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 52.7 t -63.66 -50.04 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.602 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -56.28 -46.7 79.61 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 109.201 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.559 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . -59.53 -44.06 97.07 Favored Glycine 0 N--CA 1.443 -0.847 0 O-C-N 123.945 0.778 . . . . 0.0 112.335 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.69 -54.36 47.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 122.787 0.435 . . . . 0.0 110.838 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.436 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -68.22 -31.97 71.85 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.574 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 83.9 t80 -61.74 -46.35 90.01 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 123.703 0.801 . . . . 0.0 109.848 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 52' ' ' GLY . 35.5 mt-10 -80.1 -22.75 41.84 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.016 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.404 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 46.4 m -76.35 -30.61 57.69 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.86 167.27 15.31 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -115.04 7.43 15.5 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.47 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.446 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 70.0 m -159.97 153.66 22.71 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.546 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -71.16 -36.63 72.08 Favored 'General case' 0 C--O 1.179 -2.617 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -177.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 5.2 p-10 -70.07 -27.29 64.5 Favored 'General case' 0 C--N 1.29 -1.982 0 C-N-CA 124.17 0.988 . . . . 0.0 108.792 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.46 -46.75 46.42 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.19 99.28 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.501 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 1.2 t80 -55.0 -49.5 71.36 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.317 1.447 . . . . 0.0 109.591 174.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -64.49 -53.97 39.72 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.169 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.436 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -69.03 -30.02 68.3 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.94 -176.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.0 OUTLIER -70.4 -39.53 74.42 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.02 -34.43 77.56 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 123.567 0.542 . . . . 0.0 110.096 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -71.08 -38.71 72.42 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.636 176.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -76.24 -35.46 58.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 118.976 -1.09 . . . . 0.0 111.236 -179.269 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.616 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.3 tt -67.75 -36.91 77.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.564 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.5 t80 -53.23 -53.01 56.95 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.133 1.373 . . . . 0.0 111.263 174.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.3 ptpt -67.84 -31.97 72.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.784 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.48 -43.38 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 O-C-N 123.402 0.439 . . . . 0.0 110.09 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.2 mt-30 -62.9 -54.28 41.04 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.093 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.4 ptpt -68.54 -27.87 66.48 Favored 'General case' 0 N--CA 1.398 -3.063 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.431 -176.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.7 tm-20 -62.88 -52.57 62.58 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 177.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.516 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -64.31 -38.06 89.69 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.66 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.88 -41.37 87.34 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 123.489 0.493 . . . . 0.0 111.686 178.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.2 pt-20 -72.7 -42.65 63.97 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -178.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.469 ' HE2' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.426 -1.636 0 CA-C-O 120.641 0.257 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 3.2 mm? -63.56 -52.45 61.03 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.209 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' B' ' 112' ' ' GLN . 13.0 mt-30 -68.79 -44.32 73.86 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.229 -178.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.56 -41.11 98.43 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.353 0.408 . . . . 0.0 110.977 -178.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.49 -45.87 87.81 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 49.1 mt -57.73 -58.55 7.84 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.102 177.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.7 m -55.32 -38.95 69.37 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.307 0.575 . . . . 0.0 111.167 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.2 p -77.63 -43.8 30.32 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.566 -175.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -74.64 -37.62 62.73 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.624 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 68.3 p . . . . . 0 N--CA 1.471 0.615 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -177.991 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.668 ' SD ' HD11 ' B' ' 144' ' ' ILE . 14.0 tpt . . . . . 0 C--O 1.215 -0.753 0 CA-C-O 121.285 0.564 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 24.6 tt0 -53.97 -27.15 29.55 Favored 'General case' 0 CA--C 1.567 1.627 0 C-N-CA 124.793 1.237 . . . . 0.0 112.298 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -63.27 -59.41 4.76 Favored 'General case' 0 C--O 1.276 2.46 0 CA-C-O 121.282 0.563 . . . . 0.0 110.756 178.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.668 HD11 ' SD ' ' B' ' 141' ' ' MET . 46.7 pt -62.95 -28.53 45.23 Favored 'Isoleucine or valine' 0 C--N 1.354 0.773 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 10.6 mm -65.27 -43.69 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.839 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.1 177.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.432 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 74.9 mtt85 -63.55 -40.94 98.3 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 119.97 -0.692 . . . . 0.0 111.689 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.8 p -66.6 -26.21 66.98 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.383 176.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -80.59 -49.82 10.8 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.864 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.7 pp -67.39 -29.22 68.68 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.67 -0.644 . . . . 0.0 111.446 -176.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 39.2 tpp . . . . . 0 C--O 1.239 0.529 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.17 -178.49 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.915 0 N-CA-C 114.134 0.413 . . . . 0.0 114.134 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -64.17 -10.06 20.71 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -60.24 -27.71 67.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.992 0.425 . . . . 0.0 111.24 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.59 -5.45 59.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.105 0.478 . . . . 0.0 111.062 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -96.52 -24.75 15.92 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.554 0.692 . . . . 0.0 110.153 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.551 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -96.71 124.36 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.661 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.749 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 m -86.08 151.62 23.54 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.061 -176.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -42.21 78.0 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 122.996 0.519 . . . . 0.0 110.291 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -61.45 -31.74 71.7 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.602 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.64 -52.32 15.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 -174.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.454 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -62.58 -45.99 90.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.96 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 m -67.13 -23.48 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.033 0.444 . . . . 0.0 110.561 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 25.4 t60 -68.59 -45.18 72.71 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.602 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -62.19 -38.69 90.07 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.674 177.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.462 ' HA ' HD12 ' A' ' 22' ' ' LEU . 94.2 t -54.72 -47.77 73.27 Favored 'Isoleucine or valine' 0 C--O 1.256 1.4 0 C-N-CA 123.138 0.575 . . . . 0.0 110.235 176.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -58.64 -44.75 90.16 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.132 178.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -71.13 -29.75 65.64 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.025 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.1 mt -56.99 -45.17 83.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 175.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.567 HG11 ' HE1' ' A' ' 40' ' ' MET . 15.3 t -61.95 -51.44 72.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 O-C-N 123.799 0.687 . . . . 0.0 111.436 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -63.97 -25.81 68.3 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.341 -175.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.518 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.34 -45.52 16.04 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.587 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.539 HD11 HG21 ' B' ' 145' ' ' ILE . 3.2 tt -70.57 -31.0 44.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.523 0.677 . . . . 0.0 109.391 -177.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.402 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 1.5 m-85 -127.93 90.43 47.73 Favored Pre-proline 0 N--CA 1.407 -2.616 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.086 -176.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 28.6 Cg_endo -65.09 104.31 0.58 Allowed 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 121.848 1.698 . . . . 0.0 108.156 171.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.43 117.65 17.85 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 118.203 2.668 . . . . 0.0 118.203 -168.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -80.05 -19.52 9.39 Favored 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 122.468 2.112 . . . . 0.0 110.251 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -156.94 144.65 14.02 Favored Pre-proline 0 CA--C 1.483 -1.601 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.95 -12.47 26.1 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.145 1.23 . . . . 0.0 110.167 174.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.04 -13.75 60.9 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.069 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -21.66 63.38 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.67 0.748 . . . . 0.0 109.601 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.41 2.11 54.92 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.346 -178.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -136.09 19.01 3.21 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.529 0.681 . . . . 0.0 110.222 173.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.554 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 18.1 t70 -88.61 -179.37 6.02 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.554 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.88 -28.25 64.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 174.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.6 -23.14 66.76 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.567 ' HE1' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -62.66 -40.61 97.6 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 179.097 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -65.56 -36.97 85.34 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.526 -178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.48 -43.67 93.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.504 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.51 -43.35 63.7 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.168 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.52 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 p -73.47 -34.35 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.812 -179.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.13 95.15 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 175.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -61.54 -48.63 80.14 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.787 173.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.29 96.78 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 96.8 mttt -67.07 -45.04 78.54 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.259 0.624 . . . . 0.0 111.764 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 16.0 pttp -64.69 -40.24 95.06 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 54' ' ' MET . 20.7 t -64.91 -51.43 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.229 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.267 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -54.33 -51.31 65.12 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.932 0.893 . . . . 0.0 109.967 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -36.56 93.59 Favored Glycine 0 CA--C 1.52 0.385 0 CA-C-N 116.295 -0.411 . . . . 0.0 113.131 -179.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.86 -54.32 48.39 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.793 0.806 . . . . 0.0 108.829 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.621 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.4 ptp -74.31 -28.43 61.16 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.519 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.4 ' HA ' ' CD1' ' A' ' 64' ' ' TYR . 72.5 t80 -59.23 -52.43 65.71 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 174.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -71.82 -27.86 63.2 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.123 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -71.72 -22.63 61.6 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 122.599 0.36 . . . . 0.0 111.638 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.02 168.31 10.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.446 0.641 . . . . 0.0 112.3 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -121.13 13.85 11.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.469 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -156.71 151.48 25.85 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.551 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.8 -36.5 67.59 Favored 'General case' 0 C--O 1.179 -2.614 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.554 177.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.25 -30.52 70.98 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 12.9 tp10 -71.75 -48.08 49.3 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.625 176.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.4 ' CD1' ' HA ' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -61.9 -39.4 91.87 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.602 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.522 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.5 OUTLIER -58.79 -48.23 82.01 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 124.604 1.161 . . . . 0.0 109.131 173.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -64.49 -55.62 19.52 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 122.921 0.488 . . . . 0.0 110.375 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.621 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -64.84 -30.45 71.45 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.55 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -76.1 -38.52 56.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.041 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.08 -36.25 82.96 Favored 'General case' 0 C--O 1.19 -2.069 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.71 -44.22 90.95 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.122 0.969 . . . . 0.0 112.407 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -72.87 -35.31 67.15 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.973 -178.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.631 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.5 tt -72.02 -35.67 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.585 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.16 -52.52 60.87 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 125.799 1.64 . . . . 0.0 110.818 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -67.29 -35.1 78.79 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.544 0.528 . . . . 0.0 110.584 -177.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.75 -42.18 95.07 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.6 mt-30 -63.59 -49.6 72.71 Favored 'General case' 0 CA--C 1.492 -1.278 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.1 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.607 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.4 ptpt -73.46 -29.4 62.51 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.939 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.2 tp10 -58.98 -52.45 65.7 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.69 -39.06 84.44 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.942 -178.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.5 OUTLIER -63.39 -52.98 59.36 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.246 -179.382 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.0 pt-20 -69.74 -34.15 73.45 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.347 0.481 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.088 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.445 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 2.9 mm? -69.61 -52.22 27.99 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.505 -175.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -66.16 -43.98 85.41 Favored 'General case' 0 CA--C 1.503 -0.846 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.199 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.99 -43.96 97.74 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 123.68 0.612 . . . . 0.0 110.814 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.36 -45.02 92.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.119 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 66.5 mt -57.03 -62.95 1.39 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.522 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 12.2 t -60.49 -32.77 71.75 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 120.909 0.385 . . . . 0.0 111.722 -174.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 36.9 m -71.74 -49.14 41.83 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.322 0.582 . . . . 0.0 110.329 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -76.06 -30.22 58.29 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.536 -175.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.467 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 22.8 t . . . . . 0 C--N 1.318 -0.774 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.484 ' SD ' HD11 ' B' ' 144' ' ' ILE . 11.1 tpt . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.563 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 48.4 mt-10 -53.22 -27.24 20.94 Favored 'General case' 0 C--O 1.202 -1.411 0 C-N-CA 124.823 1.249 . . . . 0.0 113.716 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.9 m -65.07 -57.33 8.9 Favored 'General case' 0 C--O 1.263 1.795 0 CA-C-O 121.274 0.559 . . . . 0.0 110.184 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.484 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.9 pp -72.55 -25.49 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.711 0.767 . . . . 0.0 110.563 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.563 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.6 mm -71.14 -33.5 51.37 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.807 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.459 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -62.53 -44.72 95.66 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -58.61 -50.74 72.72 Favored 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.123 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.01 -47.05 87.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.773 1.229 . . . . 0.0 112.956 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.572 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.2 pp -71.0 -30.89 67.25 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.85 -0.531 . . . . 0.0 111.546 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.502 -178.221 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.62 0 N-CA-C 115.309 0.884 . . . . 0.0 115.309 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.95 -5.04 27.9 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -63.29 -17.27 62.34 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.25 0.547 . . . . 0.0 111.048 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.29 -22.2 61.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.04 0.448 . . . . 0.0 110.393 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -96.45 3.06 53.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -134.07 117.23 24.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.692 0.758 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -97.35 168.38 10.44 Favored 'General case' 0 N--CA 1.402 -2.828 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.409 HE21 ' HB3' ' A' ' 12' ' ' GLN . 3.2 tt0 -56.75 -45.82 81.8 Favored 'General case' 0 C--O 1.198 -1.641 0 O-C-N 124.659 1.225 . . . . 0.0 109.667 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 5.5 p-10 -55.49 -37.46 67.85 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD12 HG23 ' A' ' 10' ' ' VAL . 3.3 tm? -73.4 -48.54 33.11 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.7 ptm180 -69.2 -41.68 76.81 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.447 -177.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -71.78 -23.63 61.61 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.581 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 16.7 t60 -72.34 -39.76 67.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.504 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -67.3 -35.58 79.75 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.847 175.426 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.7 t -58.92 -40.33 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 172.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -62.55 -44.13 97.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.859 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.544 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.6 mptp? -68.89 -35.93 77.47 Favored 'General case' 0 CA--C 1.503 -0.837 0 C-N-CA 120.204 -0.598 . . . . 0.0 112.321 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 19' ' ' VAL . 66.1 mt -54.84 -43.37 72.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.2 t -62.29 -50.44 79.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.55 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -66.01 -22.34 66.45 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.903 -176.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.84 -46.23 14.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 177.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.556 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.6 tt -70.88 -29.33 36.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.604 0 CA-C-O 122.294 1.045 . . . . 0.0 108.891 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -129.05 89.31 48.95 Favored Pre-proline 0 N--CA 1.391 -3.385 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.858 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.89 129.51 33.3 Favored 'Trans proline' 0 N--CA 1.444 -1.395 0 C-N-CA 121.954 1.769 . . . . 0.0 108.446 170.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' HD21 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -86.23 117.54 68.86 Favored Pre-proline 0 N--CA 1.408 -2.547 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -169.079 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -78.43 -23.93 8.18 Favored 'Trans proline' 0 N--CA 1.443 -1.479 0 N-CA-C 108.995 -1.194 . . . . 0.0 108.995 172.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -170.25 145.13 2.23 Favored Pre-proline 0 N--CA 1.44 -0.936 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.423 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.51 -20.39 40.94 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.832 2.355 . . . . 0.0 113.596 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -77.67 -11.52 59.88 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.064 -1.022 . . . . 0.0 112.555 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.17 -6.43 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.74 0.781 . . . . 0.0 109.129 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.2 mt -89.92 7.2 38.52 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.716 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 17.9 ptpt -129.88 15.41 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.93 0.871 . . . . 0.0 109.187 175.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 40' ' ' MET . 27.7 t70 -81.75 176.38 9.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.748 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.82 -27.47 63.9 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.034 0.445 . . . . 0.0 110.718 178.503 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.603 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.1 ttp180 -72.98 -17.1 61.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.632 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 4.4 tpp -63.08 -45.48 91.93 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.138 176.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.06 -31.16 72.24 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.711 -175.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -67.56 -49.18 64.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.375 1.47 . . . . 0.0 110.021 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 76.9 mt -67.78 -44.62 76.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.458 -177.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.4 p -71.81 -30.32 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.346 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.167 -177.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.18 -48.69 80.66 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.559 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.2 t80 -59.06 -46.64 87.74 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.468 174.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.16 95.23 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.583 0.23 . . . . 0.0 110.915 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -63.68 -46.28 86.25 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.367 0.667 . . . . 0.0 112.277 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -61.82 -41.35 97.67 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.41 -51.68 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.331 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -57.62 -48.61 78.96 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.848 0.859 . . . . 0.0 109.723 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.93 -40.25 95.1 Favored Glycine 0 N--CA 1.451 -0.356 0 O-C-N 123.762 0.664 . . . . 0.0 112.619 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.57 -54.87 40.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.351 0.26 . . . . 0.0 111.146 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.492 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.3 OUTLIER -68.68 -29.68 68.19 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -62.42 -48.49 79.45 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -79.43 -16.63 55.83 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.492 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 38.8 m -84.43 -23.32 30.04 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.23 165.74 12.96 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -107.99 2.73 23.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.584 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 80.5 p -162.75 159.61 24.39 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.436 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.33 -35.36 68.58 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.973 -176.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.58 -35.31 78.76 Favored 'General case' 0 C--O 1.209 -1.06 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -65.03 -47.05 78.78 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.717 174.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -43.37 98.48 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -57.95 -48.74 79.07 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 124.728 1.211 . . . . 0.0 109.512 175.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -64.05 -49.91 70.49 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.291 0.369 . . . . 0.0 111.575 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -70.13 -30.39 67.56 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.932 -177.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.504 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -71.43 -42.21 68.53 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.494 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.31 -35.0 74.58 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 123.363 0.665 . . . . 0.0 110.338 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 5.0 mm-40 -66.82 -48.38 69.13 Favored 'General case' 0 C--O 1.26 1.632 0 C-N-CA 123.444 0.698 . . . . 0.0 112.243 175.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.88 -37.61 70.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.904 -0.718 . . . . 0.0 110.914 -178.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.669 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -66.23 -37.75 80.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 6.8 t80 -52.59 -54.05 38.28 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 125.232 1.413 . . . . 0.0 111.193 174.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.2 ptpt -65.46 -32.41 74.0 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.097 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.6 mp -65.41 -43.59 94.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 CA-C-O 120.624 0.25 . . . . 0.0 110.508 177.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 63.7 mt-30 -63.29 -53.83 46.74 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.102 -175.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -70.07 -28.78 65.71 Favored 'General case' 0 N--CA 1.395 -3.214 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.023 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.7 tp10 -59.77 -51.7 68.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.662 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -63.31 -44.42 95.0 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.979 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 7.5 pt-20 -72.05 -40.24 68.51 Favored 'General case' 0 C--O 1.195 -1.808 0 C-N-CA 119.024 -1.071 . . . . 0.0 113.158 -177.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.2 pt-20 -72.8 -32.97 65.94 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 119.497 1.044 . . . . 0.0 111.681 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.493 -1.245 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.401 177.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.435 -1.21 0 CA-C-O 121.154 0.502 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.91 -45.22 75.0 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-O 121.13 0.49 . . . . 0.0 111.168 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -28.67 62.67 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.513 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.31 -48.37 82.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 109.251 175.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -57.1 -50.0 74.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.423 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.64 -54.19 48.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.083 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.4 t -65.09 -28.18 69.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.668 0.27 . . . . 0.0 110.913 -176.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.5 m -73.42 -41.59 63.09 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.075 0.464 . . . . 0.0 110.389 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB3' ' NE2' ' A' ' 17' ' ' HIS . 23.3 m-20 -75.97 -58.74 3.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.979 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.581 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 15.8 t . . . . . 0 C--N 1.312 -1.05 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.662 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 11.9 tpt . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -47.77 -26.47 1.61 Allowed 'General case' 0 C--O 1.193 -1.9 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.7 m -59.41 -60.6 3.6 Favored 'General case' 0 C--O 1.272 2.251 0 CA-C-N 118.756 0.707 . . . . 0.0 111.503 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.606 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.4 pp -73.63 -25.9 21.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 122.246 1.022 . . . . 0.0 110.711 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 7.3 mm -68.72 -33.71 61.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -66.6 -42.77 86.36 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 m -59.78 -26.96 66.14 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.421 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.55 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 22.8 mm-40 -80.64 -62.71 1.59 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.98 -35.2 74.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -169.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.4 tpt . . . . . 0 C--O 1.241 0.65 0 C-N-CA 120.439 -0.504 . . . . 0.0 111.313 -175.113 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.443 0 N-CA-C 115.87 1.108 . . . . 0.0 115.87 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -72.75 -6.08 42.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -62.11 -18.25 60.21 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.28 0.562 . . . . 0.0 111.534 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -90.15 0.2 57.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.468 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.5 m-70 -113.05 4.39 16.65 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.541 0.686 . . . . 0.0 110.454 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HD12 ' A' ' 14' ' ' LEU . 7.7 p -129.15 125.68 62.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.1 m -96.54 154.05 17.5 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.093 -175.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -40.62 66.4 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 123.185 0.594 . . . . 0.0 111.105 177.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.42 -33.89 74.46 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.545 HD12 HG23 ' A' ' 10' ' ' VAL . 2.8 tm? -74.4 -51.05 16.13 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -175.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB2' ' OE2' ' A' ' 51' ' ' GLU . 8.1 ptm180 -63.21 -43.05 99.23 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.785 -1.098 . . . . 0.0 112.041 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.437 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 35.6 t -67.8 -26.15 65.93 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.65 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.659 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 20.6 t60 -71.95 -38.21 69.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.075 177.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -64.45 -35.57 81.36 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.251 175.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.1 t -56.06 -49.52 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-O 121.529 0.68 . . . . 0.0 109.654 175.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -57.37 -45.15 84.73 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.798 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' CD2' ' B' ' 115' ' ' LEU . 20.2 mttp -67.51 -35.55 79.33 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.351 177.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 19' ' ' VAL . 82.3 mt -56.74 -43.92 81.2 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.629 0.372 . . . . 0.0 110.037 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HA ' HG22 ' A' ' 26' ' ' ILE . 85.5 t -63.6 -48.38 87.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.321 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -63.49 -25.21 68.15 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.538 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.01 -46.27 16.91 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.292 176.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.487 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.5 tt -70.44 -35.78 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 109.997 -177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.44 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 53.5 t80 -121.82 99.28 44.6 Favored Pre-proline 0 N--CA 1.397 -3.078 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.512 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 43.1 Cg_endo -65.11 98.08 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.967 1.778 . . . . 0.0 108.603 171.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -71.2 132.9 85.85 Favored Pre-proline 0 N--CA 1.426 -1.673 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.321 -174.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -72.63 -37.15 4.25 Favored 'Trans proline' 0 C--O 1.217 -0.561 0 C-N-CA 122.524 2.149 . . . . 0.0 111.53 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -140.73 153.46 67.87 Favored Pre-proline 0 CA--C 1.494 -1.175 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.85 -15.54 49.57 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.338 2.025 . . . . 0.0 111.72 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.47 -18.94 54.14 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.314 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.92 -6.11 53.29 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.603 0.716 . . . . 0.0 110.019 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.8 mt -90.76 -0.48 57.72 Favored 'General case' 0 C--O 1.21 -1.018 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.342 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -132.74 20.6 4.21 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.202 1.001 . . . . 0.0 109.213 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.594 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 16.5 t70 -88.5 170.22 11.08 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.407 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.6 -25.45 68.1 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 122.997 0.519 . . . . 0.0 112.029 -179.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 38.8 ttp180 -75.14 -19.14 60.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 109.723 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.574 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 7.9 tpp -61.46 -46.56 89.52 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.792 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -58.85 -29.29 66.84 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 123.263 0.352 . . . . 0.0 110.922 -177.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.4 t30 -71.58 -51.74 21.82 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.68 0.752 . . . . 0.0 110.213 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.9 -45.75 84.59 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.103 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.0 p -73.26 -28.59 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.123 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.89 -49.74 76.63 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -56.51 -46.01 80.75 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.893 174.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.88 99.8 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 120.552 0.215 . . . . 0.0 111.187 -178.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.9 mttm -64.48 -48.1 76.47 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.134 0.574 . . . . 0.0 111.313 178.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.1 pttp -63.58 -40.63 97.44 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-O 121.282 0.563 . . . . 0.0 109.6 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.416 ' O ' ' HG2' ' A' ' 54' ' ' MET . 9.1 t -64.93 -47.86 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.619 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.9 tm-20 -54.16 -49.1 70.03 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 123.744 0.818 . . . . 0.0 109.766 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.22 -43.06 98.84 Favored Glycine 0 C--O 1.236 0.247 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.491 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.54 -52.42 65.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.97 0.508 . . . . 0.0 110.344 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.506 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 1.2 ptp -71.65 -27.92 63.4 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.572 0.952 . . . . 0.0 113.572 179.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -63.1 -49.48 74.29 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -78.38 -17.4 56.51 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.369 0.604 . . . . 0.0 111.864 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.506 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 24.7 m -79.97 -19.4 47.99 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.46 166.34 11.57 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -109.87 4.31 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.909 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -161.55 160.79 29.43 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.415 ' H ' ' CD ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -70.16 -36.15 74.49 Favored 'General case' 0 C--O 1.191 -2.017 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.584 -179.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.75 -31.59 70.74 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.55 -42.56 64.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.359 -0.213 . . . . 0.0 111.016 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -43.21 96.17 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -56.27 -48.95 75.55 Favored 'General case' 0 C--O 1.197 -1.668 0 C-N-CA 124.924 1.29 . . . . 0.0 108.857 173.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -59.37 -55.55 33.25 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 123.492 0.717 . . . . 0.0 111.09 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.462 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.8 pp -71.17 -29.89 65.76 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.314 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.455 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.66 -39.43 70.31 Favored 'General case' 0 C--N 1.344 0.329 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 176.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.547 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.28 -35.84 81.69 Favored 'General case' 0 C--O 1.202 -1.415 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.655 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.4 mm-40 -67.42 -42.87 82.51 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.075 0.55 . . . . 0.0 111.668 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.437 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -71.1 -36.55 72.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.654 -179.089 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.667 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -70.49 -38.78 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.506 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 19.2 t80 -52.81 -54.3 36.15 Favored 'General case' 0 C--O 1.265 1.883 0 C-N-CA 124.972 1.309 . . . . 0.0 110.997 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -65.26 -38.4 90.19 Favored 'General case' 0 C--O 1.189 -2.081 0 O-C-N 123.823 0.702 . . . . 0.0 110.117 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.15 -40.79 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.465 0.478 . . . . 0.0 110.712 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 60.5 mt-30 -61.98 -54.95 34.59 Favored 'General case' 0 CA--C 1.496 -1.115 0 O-C-N 123.87 0.731 . . . . 0.0 110.596 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -73.21 -27.12 61.44 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.815 -177.111 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.3 tt0 -67.9 -43.57 78.98 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HA ' ' HG3' ' A' ' 82' ' ' LYS . 4.3 pp -69.57 -33.66 73.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.291 178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 41.5 mt-10 -63.89 -52.91 57.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.184 176.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.84 -38.8 92.43 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.671 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.555 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.505 -0.779 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.239 178.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.403 HG23 HD22 ' B' ' 111' ' ' LEU . 8.7 t . . . . . 0 CA--C 1.546 0.815 0 CA-C-O 120.814 0.34 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 4.2 mm? -64.35 -50.59 67.14 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.955 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -69.94 -33.77 72.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.739 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -62.33 -46.84 86.88 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.789 -0.764 . . . . 0.0 110.424 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 66.4 tp -57.9 -41.8 83.37 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.778 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.545 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 50.6 mt -61.94 -66.14 0.58 Allowed 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.229 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.3 m -52.54 -36.01 54.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.457 0.703 . . . . 0.0 112.24 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 54.5 p -76.72 -55.31 5.61 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.975 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.86 -24.34 52.63 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -174.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.659 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 42.4 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -174.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.647 ' O ' HG12 ' B' ' 145' ' ' ILE . 16.0 tpt . . . . . 0 C--O 1.204 -1.313 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.43 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 7.1 tt0 -71.59 -25.99 62.41 Favored 'General case' 0 C--O 1.193 -1.88 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.678 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.5 m -55.47 -51.83 65.67 Favored 'General case' 0 C--O 1.266 1.971 0 CA-C-O 121.134 0.492 . . . . 0.0 110.329 175.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.531 HD11 ' SD ' ' B' ' 141' ' ' MET . 43.3 pt -67.0 -32.87 59.96 Favored 'Isoleucine or valine' 0 C--N 1.342 0.249 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.647 HG12 ' O ' ' B' ' 141' ' ' MET . 22.4 mm -65.68 -33.47 63.86 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.82 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.198 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.406 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 58.0 ttp180 -65.27 -43.02 92.58 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 49.3 m -62.41 -37.45 85.85 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.767 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.628 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 12.7 mm-40 -72.82 -43.85 62.18 Favored 'General case' 0 C--O 1.199 -1.575 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 178.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.406 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -68.13 -33.92 75.38 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.362 0.528 . . . . 0.0 110.673 -177.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 CA--C 1.496 -1.11 0 CA-C-O 121.046 0.45 . . . . 0.0 109.867 174.972 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.459 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 p-90 -70.48 -12.16 61.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.49 ' CD2' ' HG3' ' A' ' 8' ' ' GLU . 0.3 OUTLIER -64.77 -19.47 65.83 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.049 0.452 . . . . 0.0 111.859 -177.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HG3' ' CD2' ' A' ' 7' ' ' HIS . 46.2 mt-10 -90.23 -8.54 50.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.438 0.637 . . . . 0.0 110.117 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -96.89 10.74 38.17 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.89 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.494 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.8 p -138.5 115.01 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.0 m -91.96 154.45 18.81 Favored 'General case' 0 C--N 1.289 -2.039 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.82 -41.62 45.29 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 123.527 0.731 . . . . 0.0 111.047 177.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.52 -41.15 72.73 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.143 0.577 . . . . 0.0 111.535 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.419 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -74.09 -50.47 19.4 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -173.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 19' ' ' VAL . 9.1 ptm180 -65.53 -38.41 89.57 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.026 -177.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -74.01 -22.67 59.5 Favored 'General case' 0 N--CA 1.423 -1.801 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.452 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 26.0 t60 -74.15 -35.26 64.05 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 174.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.629 HD23 HD21 ' A' ' 68' ' ' LEU . 3.1 mp -63.9 -38.27 90.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.3 t -60.89 -46.57 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.465 0.706 . . . . 0.0 109.421 172.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.452 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 23.5 t-80 -53.72 -48.48 69.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.438 176.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -65.21 -39.32 92.64 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.906 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 19' ' ' VAL . 49.9 mt -54.65 -48.05 72.79 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.216 0.322 . . . . 0.0 110.417 174.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.25 -48.99 85.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.018 0 O-C-N 123.842 0.714 . . . . 0.0 111.481 174.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -71.3 -20.58 62.18 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -176.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.499 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.36 -46.2 15.02 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.05 176.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.571 HD11 ' CG2' ' B' ' 145' ' ' ILE . 1.7 tt -70.47 -35.15 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-O 122.269 1.033 . . . . 0.0 108.724 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -127.87 89.14 51.42 Favored Pre-proline 0 N--CA 1.398 -3.035 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.946 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.41 84.16 0.37 Allowed 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.954 1.769 . . . . 0.0 107.663 171.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 t -52.14 134.58 40.34 Favored Pre-proline 0 N--CA 1.424 -1.735 0 CA-C-N 113.965 -1.47 . . . . 0.0 113.396 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.49 -22.35 21.42 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.203 2.602 . . . . 0.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -157.38 141.57 11.69 Favored Pre-proline 0 CA--C 1.511 -0.555 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -178.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -56.92 -18.09 26.49 Favored 'Trans proline' 0 CA--C 1.549 1.262 0 C-N-CA 122.921 2.414 . . . . 0.0 114.346 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.77 -15.17 57.98 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 121.493 -0.754 . . . . 0.0 112.06 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.39 -9.6 58.86 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.879 0.847 . . . . 0.0 109.463 176.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.8 mt -89.4 1.56 55.66 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 114.704 -1.134 . . . . 0.0 110.494 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -134.89 12.6 3.65 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.389 1.09 . . . . 0.0 109.497 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.599 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 31.7 t70 -87.36 177.65 7.06 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.985 -1.461 . . . . 0.0 110.001 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.599 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -18.08 62.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.435 0.636 . . . . 0.0 110.668 178.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -74.37 -28.02 60.92 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -64.48 -43.5 93.96 Favored 'General case' 0 C--O 1.193 -1.913 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.479 -176.394 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HA ' HG22 ' A' ' 44' ' ' VAL . 7.1 pt-20 -61.58 -29.6 70.13 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.088 0.47 . . . . 0.0 110.966 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -74.61 -44.2 51.82 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.698 176.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.74 -42.38 81.95 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.711 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.483 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 28.4 m -69.83 -35.77 66.54 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.124 0 CA-C-O 119.08 -0.486 . . . . 0.0 110.125 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.97 85.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.41 0.624 . . . . 0.0 109.691 176.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.524 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.69 -47.42 86.36 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.826 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.4 93.97 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.017 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 67.6 mttm -66.3 -44.33 83.77 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.292 0.637 . . . . 0.0 111.443 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.9 pttp -63.46 -41.11 98.62 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.599 0.714 . . . . 0.0 109.602 -179.048 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.414 HG11 ' HE2' ' A' ' 71' ' ' LYS . 38.0 t -66.29 -51.98 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.022 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.409 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.4 tm-20 -55.76 -47.79 76.4 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.271 1.029 . . . . 0.0 109.846 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.44 -38.62 96.06 Favored Glycine 0 N--CA 1.443 -0.857 0 O-C-N 123.665 0.603 . . . . 0.0 112.717 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -62.03 -51.95 65.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.452 0.644 . . . . 0.0 110.883 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.2 ptp -72.15 -27.29 62.5 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.929 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -62.54 -53.74 50.2 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.61 -26.45 65.37 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.863 -179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 t -78.87 -22.92 45.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -86.27 163.34 17.78 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.753 0.787 . . . . 0.0 112.847 -176.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -108.12 4.5 24.99 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.112 -178.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.422 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 9.8 p -167.32 154.9 8.97 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.693 0.797 . . . . 0.0 108.949 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.494 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.17 -31.8 66.26 Favored 'General case' 0 C--O 1.194 -1.866 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.616 -175.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.422 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 6.1 p-10 -72.23 -28.54 63.23 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.537 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 8.8 tp10 -73.63 -44.21 57.52 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -41.22 98.64 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-O 120.969 0.414 . . . . 0.0 109.94 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.47 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -55.85 -48.52 75.38 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 124.349 1.059 . . . . 0.0 108.293 171.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.3 t-80 -61.82 -57.91 10.0 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.732 1.213 . . . . 0.0 111.859 -175.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.601 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -66.41 -30.26 70.59 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.629 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -76.11 -34.22 59.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.438 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.606 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -65.11 -31.41 72.6 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 176.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 24.8 mm-40 -65.76 -50.14 65.82 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.954 0.883 . . . . 0.0 109.392 174.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -62.26 -45.24 94.16 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.101 -179.648 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.626 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -68.79 -34.84 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.677 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -176.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 34.0 t80 -55.63 -54.45 43.97 Favored 'General case' 0 C--O 1.271 2.223 0 C-N-CA 124.515 1.126 . . . . 0.0 110.471 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.3 ptpt -66.83 -32.45 73.73 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.83 -176.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.38 -41.67 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 O-C-N 123.152 0.283 . . . . 0.0 110.5 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 58.0 mt-30 -62.73 -51.54 66.76 Favored 'General case' 0 CA--C 1.478 -1.805 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.604 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.1 OUTLIER -70.89 -26.81 63.4 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.409 -178.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.17 -52.59 64.67 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -64.33 -39.46 93.94 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.968 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.53 -53.25 60.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 123.555 0.534 . . . . 0.0 111.345 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 77' ' ' LYS 0.266 13.1 pt-20 -76.69 -35.51 57.85 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -177.091 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.691 0 C-N-CA 118.976 -1.089 . . . . 0.0 111.8 -178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 17.6 m . . . . . 0 N--CA 1.442 -0.872 0 CA-C-O 121.304 0.573 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.29 -48.96 60.15 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.39 -178.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -66.08 -32.43 73.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.694 -177.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.78 -47.28 84.19 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.95 0.781 . . . . 0.0 109.379 175.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 110' ' ' THR . 94.8 mt -56.33 -41.56 76.27 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.778 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.83 -64.9 0.69 Allowed 'General case' 0 C--N 1.347 0.465 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.157 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.47 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 8.9 t -62.48 -33.42 74.81 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -174.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 27.2 p -70.77 -50.89 31.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -76.05 -46.49 28.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 119.136 -1.026 . . . . 0.0 112.308 -177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 9.7 m . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -172.598 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 10.4 ttm . . . . . 0 C--O 1.257 1.471 0 CA-C-O 121.416 0.627 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.574 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 32.8 mt-10 -48.89 -27.5 3.12 Favored 'General case' 0 C--O 1.191 -1.992 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -178.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 1.6 m -57.62 -59.61 4.93 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 119.415 1.007 . . . . 0.0 109.881 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . 0.413 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.7 pp -71.06 -24.24 24.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.748 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.574 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 9.4 mm -72.0 -45.65 62.82 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.389 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.755 175.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.479 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 96.8 mtt180 -63.69 -35.9 82.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 117.833 0.288 . . . . 0.0 110.902 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.1 m -62.12 -50.66 71.02 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.874 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.73 -40.7 98.03 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.474 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -75.67 -22.75 56.44 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.64 -0.663 . . . . 0.0 112.492 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 41.3 tpp . . . . . 0 C--N 1.34 0.17 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 173.236 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.914 0 N-CA-C 116.964 1.545 . . . . 0.0 116.964 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 p-90 -62.59 -16.87 58.56 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -12.59 54.24 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.987 0.423 . . . . 0.0 112.072 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.78 -26.01 34.81 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 109.818 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -90.87 2.75 55.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.687 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.462 HG23 HD12 ' A' ' 14' ' ' LEU . 7.6 p -135.6 110.52 11.42 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-O 121.535 0.683 . . . . 0.0 109.501 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.43 171.12 8.9 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.991 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.47 -43.57 68.26 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 124.298 0.999 . . . . 0.0 110.807 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -52.53 -44.23 65.62 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.599 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -75.72 -47.54 25.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -172.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' HG23 ' A' ' 19' ' ' VAL . 10.0 ptm180 -65.68 -44.72 85.36 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.486 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -68.93 -23.12 64.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 121.261 0.553 . . . . 0.0 109.545 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.669 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 34.3 t60 -68.38 -44.75 74.48 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 174.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.599 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.7 OUTLIER -63.12 -37.66 88.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 119.217 -0.993 . . . . 0.0 109.725 176.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.6 t -54.27 -46.74 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.586 0.554 . . . . 0.0 109.781 175.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.522 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 53.9 t-80 -61.05 -41.59 96.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.048 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.49 ' HE2' ' OE1' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -73.26 -31.34 64.03 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.167 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 19' ' ' VAL . 88.0 mt -56.9 -42.51 80.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 173.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 24.0 t -59.36 -53.53 46.91 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.848 172.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.49 ' OE1' ' HE2' ' A' ' 21' ' ' LYS . 46.3 mt-30 -61.76 -26.34 68.02 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.65 -46.99 13.56 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.562 177.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.651 HD11 HG23 ' B' ' 145' ' ' ILE . 4.7 tt -71.86 -29.65 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 122.111 0.957 . . . . 0.0 109.943 -177.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -130.23 83.43 63.02 Favored Pre-proline 0 N--CA 1.4 -2.954 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.306 -179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.48 84.03 0.13 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.58 2.186 . . . . 0.0 107.959 170.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.0 t -58.35 142.62 81.41 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.401 -171.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.11 -30.93 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.345 2.03 . . . . 0.0 110.57 174.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -146.12 139.77 14.87 Favored Pre-proline 0 CA--C 1.506 -0.75 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 -175.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -54.46 -22.13 26.41 Favored 'Trans proline' 0 CA--C 1.563 1.935 0 C-N-CA 122.668 2.245 . . . . 0.0 114.168 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.68 -10.0 59.72 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 121.199 -0.938 . . . . 0.0 112.105 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -80.39 -7.94 59.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 109.694 176.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 40' ' ' MET . 35.6 mt -86.93 2.73 48.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.225 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -133.12 16.12 4.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.544 0.688 . . . . 0.0 109.467 178.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 40' ' ' MET . 24.3 t70 -81.48 176.98 9.23 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.037 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.532 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.67 -22.78 62.44 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.918 -0.488 . . . . 0.0 111.725 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -73.1 -22.03 60.64 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.624 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.2 tpp -61.3 -45.61 93.74 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.838 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -59.62 -30.72 68.9 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.766 -0.773 . . . . 0.0 111.155 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -72.34 -46.05 57.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.068 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.13 -42.11 76.46 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.478 -178.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.624 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.7 p -73.26 -30.84 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.573 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.68 91.97 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.544 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -59.67 -48.36 81.96 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.272 175.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.32 97.17 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 120.617 0.246 . . . . 0.0 110.964 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -65.11 -45.4 85.28 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.5 pttp -62.47 -40.98 98.41 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.419 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.0 t -65.07 -52.78 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.991 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.214 179.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 15.1 tm-20 -57.65 -48.28 79.93 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.906 0.883 . . . . 0.0 109.652 -178.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.62 -40.52 94.78 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.963 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.28 -54.28 47.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.401 0.619 . . . . 0.0 110.5 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.5 ptp -68.75 -30.05 68.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -66.84 -38.41 86.33 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.831 0.824 . . . . 0.0 108.936 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -82.48 -25.62 33.36 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.868 -1.145 . . . . 0.0 112.648 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -82.93 -26.65 31.22 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 120.907 0.384 . . . . 0.0 111.898 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.72 155.76 25.36 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -175.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -102.33 -0.29 32.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.097 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 p -156.9 159.3 38.01 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.11 -27.61 62.75 Favored 'General case' 0 C--O 1.17 -3.12 0 C-N-CA 118.288 -1.365 . . . . 0.0 109.504 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.85 -40.35 87.88 Favored 'General case' 0 C--O 1.209 -1.037 0 O-C-N 123.625 0.578 . . . . 0.0 109.501 178.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.8 -45.52 85.91 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.82 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -47.55 82.61 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.441 ' HD1' ' N ' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -51.2 -48.63 61.94 Favored 'General case' 0 C--O 1.21 -0.988 0 C-N-CA 125.892 1.677 . . . . 0.0 109.756 174.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 28.7 t-80 -74.15 -49.39 23.9 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.676 -169.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -67.73 -29.46 68.7 Favored 'General case' 0 C--O 1.249 1.065 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.502 -178.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -73.22 -40.03 65.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.171 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.55 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.1 -34.5 75.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 123.381 0.425 . . . . 0.0 109.93 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 7.4 mm-40 -63.68 -46.28 86.28 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.362 0.665 . . . . 0.0 111.005 175.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.32 -36.97 69.02 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.345 -0.942 . . . . 0.0 112.108 -178.163 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.604 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -67.03 -38.75 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.516 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.96 -54.51 37.94 Favored 'General case' 0 C--O 1.254 1.329 0 C-N-CA 124.824 1.25 . . . . 0.0 111.271 175.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -66.04 -33.84 76.72 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.461 -175.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.71 -44.31 96.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 123.439 0.462 . . . . 0.0 111.103 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.2 mt-30 -61.27 -50.75 71.74 Favored 'General case' 0 CA--C 1.49 -1.341 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -176.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.615 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -73.62 -29.17 62.2 Favored 'General case' 0 N--CA 1.395 -3.221 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.961 -177.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 28.4 tt0 -62.61 -52.62 62.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.843 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 3.9 pp -60.61 -45.45 93.96 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 123.818 0.699 . . . . 0.0 110.813 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -59.55 -53.72 54.83 Favored 'General case' 0 N--CA 1.401 -2.923 0 O-C-N 123.898 0.749 . . . . 0.0 111.29 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.1 pt-20 -71.92 -34.27 68.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 119.769 -0.772 . . . . 0.0 113.043 -176.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.477 ' NZ ' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.65 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.482 179.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 47.4 m . . . . . 0 N--CA 1.44 -0.933 0 CA-C-O 121.017 0.436 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.49 -54.9 21.62 Favored 'General case' 0 C--O 1.247 0.957 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.949 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' GLN . . . . . 0.41 ' HB2' ' OH ' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -73.07 -25.14 60.8 Favored 'General case' 0 C--O 1.247 0.971 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.574 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -60.1 -51.27 70.34 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.88 -45.61 86.11 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.935 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.12 -61.51 2.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.471 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.5 m -60.21 -40.61 90.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.424 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 60.7 p -77.39 -35.12 54.64 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.039 -174.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.1 -49.86 32.87 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.624 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' SER . . . . . 0.669 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 37.9 t . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -177.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.843 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 15.3 ttt . . . . . 0 N--CA 1.443 -0.795 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.602 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.6 mt-10 -48.57 -27.99 3.14 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -178.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.0 p -56.93 -59.7 4.66 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 121.671 0.748 . . . . 0.0 111.485 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.19 -24.3 24.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.406 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.651 HG23 HD11 ' A' ' 26' ' ' ILE . 14.8 mm -63.43 -46.45 95.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.79 173.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -59.85 -42.61 94.03 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 123.994 0.809 . . . . 0.0 109.19 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.5 m -66.33 -34.07 77.14 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.762 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -47.33 22.99 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.482 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.1 pp -66.94 -25.25 66.26 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 50.5 tpp . . . . . 0 CA--C 1.514 -0.416 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 175.934 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.358 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.3 m -82.23 160.48 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.228 0 CA-C-O 121.183 0.516 . . . . 0.0 111.449 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -83.88 102.66 12.54 Favored 'General case' 0 N--CA 1.414 -2.256 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.946 -173.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -108.16 118.8 37.7 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -28.68 53.54 Favored Glycine 0 C--N 1.31 -0.887 0 N-CA-C 114.176 0.43 . . . . 0.0 114.176 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 54.5 p-90 -67.18 -19.24 65.54 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -71.32 -10.21 59.38 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 119.765 -0.774 . . . . 0.0 113.017 -175.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -83.69 -7.12 59.55 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.762 0.791 . . . . 0.0 109.185 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -99.81 7.14 45.23 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.001 -177.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.8 p -139.54 114.67 7.96 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.526 0.679 . . . . 0.0 109.348 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.1 166.28 13.5 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -49.13 -41.61 36.69 Favored 'General case' 0 C--O 1.206 -1.224 0 C-N-CA 124.351 1.061 . . . . 0.0 111.154 175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -52.06 -47.07 65.3 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.203 0.601 . . . . 0.0 111.925 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.414 HD13 HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.05 -45.83 59.32 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.3 ptm180 -70.07 -42.58 72.6 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.752 -177.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.9 t -67.89 -26.74 66.15 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.602 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 8.7 t60 -70.7 -43.35 69.18 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 176.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.657 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -65.36 -37.91 88.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.478 176.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -57.05 -45.43 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 173.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 12.2 t-80 -57.98 -44.97 87.41 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.58 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.1 mptp? -64.36 -38.17 90.09 Favored 'General case' 0 CA--C 1.506 -0.713 0 C-N-CA 119.977 -0.689 . . . . 0.0 112.635 177.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.4 mt -54.75 -44.92 74.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 123.381 0.426 . . . . 0.0 109.88 176.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.433 ' HA ' HG22 ' A' ' 26' ' ' ILE . 54.0 t -63.83 -48.4 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.812 174.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 35.4 mt-30 -60.25 -27.96 67.66 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 120.954 0.407 . . . . 0.0 111.906 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.583 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.21 -46.58 14.61 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.772 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.544 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.7 tt -71.35 -30.18 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.699 0.762 . . . . 0.0 110.12 -176.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 70.9 t80 -127.89 103.87 21.14 Favored Pre-proline 0 N--CA 1.409 -2.494 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.341 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.454 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 57.1 Cg_endo -67.57 76.5 0.54 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.848 2.365 . . . . 0.0 110.463 175.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 13.0 t -60.46 126.42 84.56 Favored Pre-proline 0 N--CA 1.423 -1.807 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.976 -175.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HA ' ' H ' ' B' ' 131' ' ' GLY . 45.0 Cg_endo -73.18 -29.91 11.1 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 122.341 2.027 . . . . 0.0 111.574 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -146.9 143.87 19.12 Favored Pre-proline 0 C--N 1.308 -1.233 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.416 ' HA ' HD12 ' A' ' 35' ' ' LEU . 6.9 Cg_endo -53.74 -18.28 11.93 Favored 'Trans proline' 0 CA--C 1.557 1.634 0 C-N-CA 122.652 2.235 . . . . 0.0 114.05 175.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.56 -13.41 59.55 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.566 -0.709 . . . . 0.0 112.469 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.448 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -78.36 -6.53 55.43 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.452 1.12 . . . . 0.0 108.747 175.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.462 ' HA ' ' HE2' ' A' ' 40' ' ' MET . 21.8 mt -89.97 7.75 35.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.383 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.72 18.55 4.24 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.817 0.818 . . . . 0.0 109.323 173.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.598 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 20.5 t70 -80.79 173.78 12.27 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.477 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.598 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -65.5 -24.98 67.27 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 121.955 -0.465 . . . . 0.0 110.901 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 33.1 ttm180 -74.9 -22.35 58.68 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.739 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.0 tpp -59.4 -45.22 92.1 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.732 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -56.3 -36.09 68.27 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.199 0.524 . . . . 0.0 109.866 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -76.15 -43.87 40.86 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.377 1.071 . . . . 0.0 111.372 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 78.6 mt -70.04 -40.86 74.87 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.696 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.739 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.32 -30.7 31.41 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.896 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -61.21 -49.17 78.21 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 174.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.61 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 6.8 t80 -57.96 -44.44 87.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.674 0.79 . . . . 0.0 110.215 174.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.64 87.87 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.636 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -68.82 -40.3 79.57 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 1.4 ptmt -65.44 -41.74 93.16 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.359 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.7 t -65.5 -52.7 48.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.629 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -57.78 -51.28 70.21 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.648 0.779 . . . . 0.0 110.015 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -39.18 93.33 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 123.495 0.497 . . . . 0.0 112.941 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.96 -51.63 68.46 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 121.442 0.639 . . . . 0.0 110.91 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 2.3 ptp -73.59 -27.59 61.38 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.321 -0.854 . . . . 0.0 113.272 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -62.03 -47.39 84.94 Favored 'General case' 0 C--O 1.2 -1.503 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -74.04 -22.62 59.49 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.2 t -77.54 -32.26 53.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.96 169.46 11.52 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -120.29 17.61 12.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.911 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.7 p -167.88 151.11 5.92 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.55 -33.34 73.91 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.185 -177.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -65.65 -36.96 85.19 Favored 'General case' 0 C--O 1.198 -1.615 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.285 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.546 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 9.4 tp10 -67.84 -46.45 71.76 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.63 99.25 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.762 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -48.72 78.9 Favored 'General case' 0 C--O 1.206 -1.22 0 C-N-CA 123.766 0.826 . . . . 0.0 109.054 172.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.417 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m170 -61.23 -55.91 26.62 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.6 pp -64.9 -29.65 70.6 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 18' ' ' LEU . 0.3 OUTLIER -76.04 -39.19 56.09 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.522 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.8 -29.12 69.94 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 123.02 0.528 . . . . 0.0 109.642 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.466 ' HG3' ' H ' ' B' ' 102' ' ' SER . 72.7 mm-40 -67.81 -53.04 30.11 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 123.291 0.637 . . . . 0.0 111.656 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.42 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -66.16 -35.65 81.03 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 119.338 -0.945 . . . . 0.0 111.46 -177.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.567 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.99 -40.24 80.69 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.8 t80 -52.29 -54.56 29.85 Favored 'General case' 0 C--O 1.257 1.489 0 C-N-CA 125.047 1.339 . . . . 0.0 111.416 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 74' ' ' LYS . 16.1 ptpt -67.86 -35.46 78.59 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.017 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -62.39 -39.69 85.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 O-C-N 123.424 0.453 . . . . 0.0 110.83 177.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.583 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 46.6 mt-30 -64.36 -55.62 19.88 Favored 'General case' 0 CA--C 1.485 -1.537 0 O-C-N 123.518 0.511 . . . . 0.0 110.822 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.559 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.3 ptpt -68.0 -28.66 67.61 Favored 'General case' 0 N--CA 1.417 -2.084 0 C-N-CA 119.632 -0.827 . . . . 0.0 112.459 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 82' ' ' LYS . 13.5 tp10 -58.57 -53.16 61.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 123.639 0.587 . . . . 0.0 109.833 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -67.34 -38.94 85.65 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 123.199 0.312 . . . . 0.0 111.708 -177.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -62.73 -53.16 58.6 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.541 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.7 pt-20 -72.06 -34.32 68.65 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 120.174 -0.61 . . . . 0.0 112.307 -176.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.603 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -64.17 -49.59 71.46 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 119.594 -0.843 . . . . 0.0 111.609 -178.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' B' ' 137' ' ' LEU . 0.6 OUTLIER -76.71 -28.65 55.93 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.124 -174.588 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -85.29 -57.53 3.04 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.7 p -123.61 -14.05 7.38 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 118.471 2.767 . . . . 0.0 118.471 -166.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.603 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 4.1 ptp180 -86.73 -26.75 24.06 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 117.591 -1.644 . . . . 0.0 110.605 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.9 mt . . . . . 0 C--O 1.251 1.161 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.664 177.311 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.715 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . 0.466 ' H ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 m -124.85 -67.73 0.89 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . 0.328 25.6 ptt? 42.35 73.22 0.14 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.4 m -78.84 -34.25 45.31 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 105.08 -2.193 . . . . 0.0 105.08 171.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -103.98 117.42 34.27 Favored 'General case' 0 N--CA 1.417 -2.081 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -78.29 -1.16 31.74 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . 0.622 ' HA2' HE22 ' B' ' 109' ' ' GLN . . . -88.81 65.53 3.26 Favored Glycine 0 N--CA 1.424 -2.117 0 C-N-CA 120.569 -0.824 . . . . 0.0 111.363 175.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.429 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 35.3 p-10 -115.67 -1.24 12.75 Favored 'General case' 0 C--N 1.296 -1.731 0 CA-C-N 115.164 -0.518 . . . . 0.0 110.764 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.622 HE22 ' HA2' ' B' ' 107' ' ' GLY . 0.0 OUTLIER -60.26 -34.97 74.48 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.066 -176.605 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 27.2 m -56.85 -50.03 73.67 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 122.884 0.474 . . . . 0.0 110.815 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -72.95 -39.97 65.77 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.314 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 14.8 mm100 -63.49 -43.22 97.88 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.066 0.46 . . . . 0.0 111.076 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -66.89 -36.74 82.98 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 122.721 0.408 . . . . 0.0 110.77 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 61.6 tp -56.57 -53.85 52.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.546 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.43 -45.73 90.72 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.954 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.6 m -57.02 -36.14 70.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.985 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 38.5 m -77.27 -58.42 3.28 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.231 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.32 -60.12 4.36 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.611 ' O ' ' HA ' ' B' ' 123' ' ' SER . 6.0 m -74.0 -51.37 16.12 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.664 -171.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.91 -60.32 2.2 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 34.8 t -62.22 -56.41 18.91 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -79.57 -23.98 42.4 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.242 -0.286 . . . . 0.0 111.676 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.611 ' HA ' ' O ' ' B' ' 119' ' ' SER . 19.6 m 71.67 -59.15 0.56 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.792 1.237 . . . . 0.0 113.914 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -116.29 132.79 56.57 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.005 0.431 . . . . 0.0 111.008 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -175.89 65.59 0.1 OUTLIER Glycine 0 N--CA 1.421 -2.355 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -98.71 29.32 11.84 Favored Glycine 0 N--CA 1.443 -0.863 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -152.18 86.78 0.14 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 177.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . 0.401 ' O ' HD11 ' A' ' 35' ' ' LEU . 28.2 t -142.4 145.59 33.98 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . 0.445 ' HA2' HG23 ' A' ' 29' ' ' THR . . . -154.66 160.09 29.38 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 110.242 -1.143 . . . . 0.0 110.242 179.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 178.78 43.32 0.07 OUTLIER Glycine 0 N--CA 1.44 -1.092 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.746 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . 0.448 ' H ' ' HA ' ' A' ' 30' ' ' PRO . . . -96.54 85.48 0.86 Allowed Glycine 0 C--N 1.301 -1.403 0 N-CA-C 110.359 -1.097 . . . . 0.0 110.359 178.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.8 p -68.75 115.56 8.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 121.327 0.585 . . . . 0.0 110.791 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 106.68 -9.76 41.12 Favored Glycine 0 N--CA 1.432 -1.595 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.117 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 119.87 178.86 16.44 Favored Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.064 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -142.62 75.46 0.32 Allowed Glycine 0 N--CA 1.431 -1.648 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.4 m -155.79 32.81 0.35 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.409 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.8 pp -94.15 -16.04 24.1 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.584 -173.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.613 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 3.2 mp0 -45.98 -56.87 4.94 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.038 1.335 . . . . 0.0 109.423 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 63.4 m 48.35 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.913 1.685 . . . . 0.0 114.608 175.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.31 -33.21 67.21 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.609 ' O ' HG12 ' B' ' 145' ' ' ILE . 14.3 tpt -58.77 -37.14 75.63 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.201 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 38.5 mt-10 -58.85 -27.28 64.99 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 24.8 t -61.57 -54.29 45.05 Favored 'General case' 0 C--O 1.249 1.066 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.543 HD11 ' SD ' ' B' ' 141' ' ' MET . 49.3 pt -66.01 -29.26 46.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.609 HG12 ' O ' ' B' ' 141' ' ' MET . 14.2 mm -64.16 -43.39 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.813 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 20.7 mtm180 -59.1 -42.51 90.65 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 175.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 48.3 m -59.94 -41.65 92.28 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.517 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 144' ' ' ILE . 28.9 mt-10 -77.2 -38.42 51.52 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.888 -0.508 . . . . 0.0 112.358 -178.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.55 HD23 HG22 ' B' ' 145' ' ' ILE . 4.4 pp -75.36 -24.87 57.33 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 58.5 ttp -53.7 -58.5 6.99 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -101.55 155.76 17.89 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.756 0 O-C-N 123.416 0.447 . . . . 0.0 109.999 -178.101 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.487 -1.692 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 m -93.32 147.27 5.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 CA-C-O 120.712 0.292 . . . . 0.0 110.481 177.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.488 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -109.48 125.89 52.94 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.483 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 11.7 ptpt -161.82 102.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.605 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.42 -2.99 6.27 Favored Glycine 0 N--CA 1.461 0.307 0 N-CA-C 116.081 1.193 . . . . 0.0 116.081 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.483 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 69.1 p-90 -74.03 -7.09 51.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.06 0.93 . . . . 0.0 111.079 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -55.28 -25.03 31.4 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -87.26 0.24 55.68 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.431 0.634 . . . . 0.0 111.725 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -106.7 7.05 30.27 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.711 0.767 . . . . 0.0 109.907 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.99 110.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.698 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.442 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -91.05 160.03 15.81 Favored 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -176.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -38.36 67.69 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.127 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.38 -39.16 85.62 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 120.901 0.381 . . . . 0.0 111.489 -177.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.08 -48.75 61.87 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -68.3 -38.99 82.17 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.738 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.9 t -65.15 -29.85 70.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.766 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 66.2 t60 -69.64 -42.63 74.02 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.46 176.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.593 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -60.88 -38.68 86.45 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 97.9 t -59.08 -51.04 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-O 121.296 0.569 . . . . 0.0 109.673 174.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -51.29 -47.88 62.44 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.576 1.15 . . . . 0.0 110.605 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.766 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 54.7 mttm -67.99 -37.86 81.98 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 86.9 mt -54.7 -42.88 72.01 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.5 t -61.69 -52.05 65.42 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.938 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.336 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -74.1 -14.51 60.99 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 119.711 -0.796 . . . . 0.0 112.936 -175.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 79' ' ' LEU . . . -81.27 -46.27 15.02 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.757 173.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 5.0 tt -72.72 -28.93 28.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.618 0.723 . . . . 0.0 109.866 -177.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -132.59 92.57 26.95 Favored Pre-proline 0 N--CA 1.401 -2.894 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.216 -175.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.74 91.93 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.423 2.082 . . . . 0.0 107.928 170.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.5 123.23 78.12 Favored Pre-proline 0 N--CA 1.422 -1.872 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.893 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.03 -23.44 12.16 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.115 2.543 . . . . 0.0 111.683 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -143.87 143.04 21.62 Favored Pre-proline 0 CA--C 1.491 -1.302 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.28 -13.64 38.3 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 121.496 1.464 . . . . 0.0 110.697 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.32 -14.18 55.76 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.754 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.83 -12.14 60.31 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 122.047 0.927 . . . . 0.0 109.325 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 26.1 mt -83.98 0.61 47.32 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.464 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -133.18 19.01 4.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.91 0.862 . . . . 0.0 109.572 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.493 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.9 t70 -77.37 174.68 10.53 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.692 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.482 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -69.79 -27.41 64.88 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.327 0.585 . . . . 0.0 109.61 176.759 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 14.7 ttm180 -73.48 -21.3 60.46 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.297 0.57 . . . . 0.0 110.053 177.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.532 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -61.28 -40.34 93.74 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.491 177.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.0 pt-20 -62.56 -30.76 71.54 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 118.62 -1.232 . . . . 0.0 109.896 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -70.69 -48.5 54.39 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.71 1.204 . . . . 0.0 110.527 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.7 mt -67.92 -44.78 76.08 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.833 -178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.532 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.5 p -72.18 -32.34 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.414 -0.515 . . . . 0.0 109.93 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.62 -41.51 99.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.498 0.666 . . . . 0.0 109.319 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -60.56 -50.31 74.03 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.618 173.156 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.84 -40.57 88.96 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.989 0.423 . . . . 0.0 110.964 -177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.8 mttt -65.03 -48.27 74.46 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.301 177.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 15.0 pttp -63.8 -38.46 91.19 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -177.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 46' ' ' TYR . 55.2 t -64.43 -53.3 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.204 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -56.05 -46.81 78.79 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 124.09 0.869 . . . . 0.0 109.696 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.15 99.72 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.646 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -58.07 -53.27 60.1 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 123.292 0.637 . . . . 0.0 110.828 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.56 ' HB3' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.3 -32.92 74.22 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 178.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -64.66 -41.99 95.72 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 123.328 0.651 . . . . 0.0 109.56 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -80.43 -22.09 41.53 Favored 'General case' 0 C--N 1.314 -0.965 0 O-C-N 122.011 -0.431 . . . . 0.0 111.995 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.1 t -79.14 -54.18 6.24 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 160.08 14.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -171.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -102.59 -2.1 29.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.588 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 27.3 m -154.82 160.23 41.11 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.26 -36.9 69.15 Favored 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 118.799 -1.16 . . . . 0.0 111.753 -179.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.46 -38.14 83.22 Favored 'General case' 0 C--O 1.197 -1.66 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -47.09 77.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.299 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -45.09 91.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.53 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.1 OUTLIER -55.98 -48.67 75.41 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 125.66 1.584 . . . . 0.0 109.12 175.167 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -61.25 -55.56 30.54 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 123.842 0.857 . . . . 0.0 111.851 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.56 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.9 pp -68.61 -29.3 67.79 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 120.469 -0.493 . . . . 0.0 111.336 -175.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.593 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -71.76 -40.94 69.0 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 174.516 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.13 -38.07 78.77 Favored 'General case' 0 C--O 1.203 -1.363 0 C-N-CA 123.463 0.705 . . . . 0.0 109.699 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 4.8 mm-40 -60.94 -50.08 74.87 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.188 0.995 . . . . 0.0 111.825 175.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.429 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.77 -35.95 67.55 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 119.222 -0.991 . . . . 0.0 111.642 -177.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.65 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -67.93 -36.96 77.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.7 -54.23 40.87 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 124.976 1.311 . . . . 0.0 110.985 175.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -32.29 72.01 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.195 -176.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -64.06 -43.8 97.61 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 59.8 mt-30 -63.17 -51.62 65.67 Favored 'General case' 0 CA--C 1.493 -1.241 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.903 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.1 ptpt -72.16 -27.61 62.7 Favored 'General case' 0 N--CA 1.402 -2.852 0 C-N-CA 119.048 -1.061 . . . . 0.0 112.911 -177.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -60.72 -52.87 63.26 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.1 pp -65.38 -35.67 81.67 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.97 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.75 -44.54 73.53 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -71.19 -34.77 71.21 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 121.973 -0.454 . . . . 0.0 111.479 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' NZ ' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -74.38 -32.62 62.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.354 178.275 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.562 ' HG2' ' HG ' ' B' ' 137' ' ' LEU . 29.4 tpt180 -70.3 -40.14 74.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -62.18 -35.58 79.28 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 174.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 62.0 m 77.72 73.45 0.06 Allowed 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.442 177.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -101.8 -10.56 19.81 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.14 176.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 C--N 1.304 -1.384 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.435 176.897 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.336 0 N-CA-C 111.34 -0.704 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.0 m -77.94 97.22 5.25 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.163 0.506 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 56.9 ttp -108.66 -67.07 1.0 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 11.8 p -102.91 154.61 19.04 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -105.75 145.26 31.37 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.454 ' HA ' HE22 ' B' ' 109' ' ' GLN . 98.5 m-85 -124.71 133.53 53.16 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.66 -25.56 5.31 Favored Glycine 0 C--N 1.302 -1.347 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -175.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 20.0 p-10 -87.42 -19.31 28.24 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 113.956 -1.122 . . . . 0.0 113.93 -174.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.503 ' H ' ' CD ' ' B' ' 109' ' ' GLN 0.381 0.0 OUTLIER -76.86 -11.73 59.86 Favored 'General case' 0 C--N 1.274 -2.679 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -178.059 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.3 m -69.85 -41.58 74.68 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.36 -40.13 74.21 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.845 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 25.1 mt-30 -61.87 -36.87 82.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.742 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -61.84 -46.88 87.57 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.734 0.646 . . . . 0.0 109.731 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 90.0 mt -54.71 -47.2 74.01 Favored 'General case' 0 C--O 1.249 1.042 0 O-C-N 123.751 0.657 . . . . 0.0 110.081 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.497 HD23 ' CD ' ' A' ' 21' ' ' LYS . 85.8 mt -52.87 -62.05 1.9 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.532 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.53 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 7.3 t -69.08 -25.79 64.61 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.627 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -71.39 -52.12 20.32 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.406 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.536 ' HB2' ' NE2' ' A' ' 17' ' ' HIS . 54.1 m-20 -75.72 -31.97 59.86 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.676 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 47.0 p -71.22 -54.79 9.72 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.058 -0.657 . . . . 0.0 111.894 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.0 mt -80.9 -52.63 7.25 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 15.3 m -74.73 -48.31 26.44 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -82.8 -3.18 56.36 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.888 -0.507 . . . . 0.0 111.849 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 67.7 p 53.44 42.99 31.92 Favored 'General case' 0 C--O 1.245 0.844 0 C-N-CA 124.812 1.245 . . . . 0.0 111.811 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 10.4 t70 68.13 -79.41 0.04 OUTLIER 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.459 1.104 . . . . 0.0 112.406 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 82.04 -53.25 4.73 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 112.076 -0.41 . . . . 0.0 112.076 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 73.76 19.2 79.72 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -110.29 23.66 20.11 Favored Glycine 0 N--CA 1.437 -1.253 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 -176.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 40.7 m -85.05 109.11 17.99 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -122.3 10.48 9.31 Favored Glycine 0 CA--C 1.5 -0.868 0 C-N-CA 119.783 -1.199 . . . . 0.0 111.995 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -79.79 123.35 6.07 Favored Glycine 0 N--CA 1.431 -1.643 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 176.58 150.51 8.27 Favored Glycine 0 N--CA 1.422 -2.244 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.9 p -161.97 -60.17 0.05 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 76.29 -68.8 2.33 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.705 -0.68 . . . . 0.0 113.674 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 166.72 59.73 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 110.684 -0.966 . . . . 0.0 110.684 -177.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 84.53 -84.11 1.6 Allowed Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.2 p -155.25 131.69 10.41 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.562 ' HG ' ' HG2' ' A' ' 83' ' ' ARG . 5.5 mp -106.04 -25.2 12.16 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -169.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.501 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 1.3 mp0 -59.03 -61.41 2.66 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 123.852 0.72 . . . . 0.0 110.808 -174.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t 45.61 -101.34 0.05 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.544 1.138 . . . . 0.0 113.736 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -74.99 -20.1 59.8 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 123.827 0.851 . . . . 0.0 110.035 -176.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.5 ttt -71.22 -26.24 62.84 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.638 -177.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.7 mt-10 -57.1 -27.9 62.18 Favored 'General case' 0 C--O 1.206 -1.226 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.2 m -67.39 -46.77 72.3 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 120.791 0.329 . . . . 0.0 110.417 178.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.446 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.8 pp -73.16 -27.73 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.726 0.774 . . . . 0.0 109.853 179.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 8.9 mm -66.77 -44.44 89.3 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.854 174.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.562 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 23.7 ttt180 -64.66 -37.32 87.16 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.367 0.417 . . . . 0.0 110.121 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 11.4 t -63.61 -43.68 96.19 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.75 -51.36 65.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.179 0.591 . . . . 0.0 111.65 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.576 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.4 pp -66.85 -24.52 66.15 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -176.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 24.3 ttt -59.86 -45.36 92.69 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.866 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -142.01 138.19 31.68 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.89 -173.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.053 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.528 178.985 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.644 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.0 m -80.59 133.68 28.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-O 121.35 0.595 . . . . 0.0 112.495 -178.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.475 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.2 OUTLIER -99.88 75.65 1.9 Allowed 'General case' 0 N--CA 1.439 -1.007 0 CA-C-O 121.817 0.817 . . . . 0.0 110.935 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.547 ' HZ2' ' HA ' ' A' ' 56' ' ' GLU . 17.6 ptpt -94.4 94.53 8.31 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.274 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.07 0.2 8.22 Favored Glycine 0 C--O 1.218 -0.852 0 CA-C-N 115.079 -0.964 . . . . 0.0 115.291 -173.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.52 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 69.9 p-90 -77.49 -4.21 44.43 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 122.119 -0.636 . . . . 0.0 110.851 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -59.8 -18.09 40.94 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.267 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 11.4 pt-20 -90.32 -10.84 42.61 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.065 0.46 . . . . 0.0 111.059 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 64.6 m-70 -99.93 6.13 45.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.466 0.651 . . . . 0.0 110.575 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.455 HG23 HD12 ' A' ' 14' ' ' LEU . 6.1 p -127.76 110.64 22.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 CA-C-N 114.913 -1.039 . . . . 0.0 108.304 177.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.5 m -74.94 150.16 39.16 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.121 -175.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -58.59 -38.36 77.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.305 179.336 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 16.6 m-20 -67.29 -35.62 79.85 Favored 'General case' 0 C--O 1.197 -1.706 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.56 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.455 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -67.6 -50.04 60.17 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -63.23 -42.01 99.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.831 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.6 t -69.47 -30.35 68.23 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.666 0.746 . . . . 0.0 110.235 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.616 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 12.7 t60 -75.0 -35.44 62.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.378 -178.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 HD21 ' A' ' 68' ' ' LEU . 1.6 mp -65.63 -37.76 87.46 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 174.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.5 t -57.29 -46.02 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.6 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.0 t-80 -55.96 -47.96 76.69 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.824 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.616 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 3.4 mptp? -64.14 -37.66 88.25 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 178.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 26' ' ' ILE . 91.9 mt -53.53 -47.24 70.14 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.9 t -58.84 -50.85 77.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.218 173.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.2 mt-30 -60.46 -32.67 71.62 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.46 -43.34 19.0 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.526 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.55 -30.48 42.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 122.078 0.942 . . . . 0.0 109.552 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.576 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 75.9 t80 -127.95 86.26 58.6 Favored Pre-proline 0 N--CA 1.402 -2.873 0 CA-C-N 114.371 -1.286 . . . . 0.0 108.547 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.12 78.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.11 2.54 . . . . 0.0 109.678 171.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 t -59.28 136.94 88.62 Favored Pre-proline 0 N--CA 1.419 -2.0 0 CA-C-N 114.387 -1.278 . . . . 0.0 113.093 -173.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -75.66 -19.35 16.59 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.774 2.316 . . . . 0.0 111.513 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -160.89 142.61 9.06 Favored Pre-proline 0 CA--C 1.51 -0.594 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -53.41 -21.18 17.36 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 C-N-CA 122.884 2.389 . . . . 0.0 114.352 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.03 -12.72 60.01 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 121.295 -0.878 . . . . 0.0 112.885 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.19 56.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.023 0.916 . . . . 0.0 109.209 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 40' ' ' MET . 19.4 mt -89.69 7.11 38.38 Favored 'General case' 0 C--O 1.214 -0.795 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.999 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -132.76 19.02 4.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.745 0.783 . . . . 0.0 109.373 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.604 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.8 t70 -82.84 175.51 10.03 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.295 -178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.62 -25.91 62.35 Favored 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.901 -0.499 . . . . 0.0 111.008 177.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.6 ttp180 -69.74 -21.44 63.46 Favored 'General case' 0 C--O 1.251 1.144 0 CA-C-O 121.79 0.805 . . . . 0.0 109.597 175.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.682 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.8 tpp -63.03 -41.36 99.51 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.345 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -59.57 -31.66 69.65 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.713 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.474 HD21 HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -75.38 -45.84 36.67 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.004 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.39 -42.53 92.56 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.334 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.682 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.1 p -73.4 -31.15 32.41 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.01 -48.4 81.85 Favored 'General case' 0 C--N 1.35 0.588 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -58.92 -46.65 87.43 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.322 175.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -45.23 94.52 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.07 0.231 . . . . 0.0 110.892 -178.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -62.45 -47.64 83.14 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 16.3 pttp -65.44 -35.58 81.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.109 0.48 . . . . 0.0 110.412 -177.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.772 ' O ' ' HG2' ' A' ' 54' ' ' MET . 42.8 t -70.71 -51.06 39.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.759 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -57.23 -45.51 83.83 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.352 0.661 . . . . 0.0 110.189 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.34 -38.27 96.16 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.874 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HB3' ' HE3' ' A' ' 54' ' ' MET . 21.4 t70 -58.13 -50.8 72.22 Favored 'General case' 0 CA--C 1.492 -1.279 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.772 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.7 OUTLIER -65.98 -43.24 88.44 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.931 -175.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.8 t80 -56.59 -42.07 78.07 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 123.874 0.869 . . . . 0.0 108.774 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HA ' ' HZ2' ' A' ' 4' ' ' LYS . 12.5 mm-40 -83.2 -13.71 54.84 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.9 m -90.0 -24.76 21.15 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.642 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -100.99 164.48 11.79 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.586 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -125.22 19.08 8.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 m -158.78 153.85 25.25 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.437 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.56 -39.45 67.43 Favored 'General case' 0 C--O 1.191 -1.979 0 C-N-CA 118.954 -1.099 . . . . 0.0 111.532 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.96 -30.08 71.19 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -72.65 -49.8 29.36 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.811 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -42.48 98.56 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -57.75 -49.12 77.65 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 125.328 1.451 . . . . 0.0 109.781 174.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.3 t-80 -65.16 -50.86 64.33 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 123.223 0.327 . . . . 0.0 111.048 -173.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 54' ' ' MET . 3.6 pp -68.62 -30.99 69.83 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-O 120.991 0.424 . . . . 0.0 111.012 -176.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.7 pp -73.99 -35.54 64.45 Favored 'General case' 0 N--CA 1.441 -0.907 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.79 -28.36 69.51 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.961 177.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 22.5 mm-40 -73.42 -42.58 61.88 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-O 120.994 0.426 . . . . 0.0 111.612 176.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.39 -37.45 74.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 118.626 -1.23 . . . . 0.0 110.632 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.6 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -68.77 -36.48 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.552 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 0.9 OUTLIER -51.4 -53.92 31.85 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.599 1.56 . . . . 0.0 110.801 173.508 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -67.08 -32.92 74.42 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.02 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.61 -42.98 97.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 123.045 0.215 . . . . 0.0 110.983 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.3 mt-30 -63.58 -52.25 61.78 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.567 0.699 . . . . 0.0 110.721 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 15.0 ptpt -71.05 -27.69 63.83 Favored 'General case' 0 N--CA 1.415 -2.179 0 C-N-CA 119.289 -0.964 . . . . 0.0 112.21 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.9 tp10 -59.98 -52.52 65.06 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -61.83 -42.13 98.65 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.791 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -59.26 -53.46 58.02 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.248 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -70.42 -37.04 74.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.461 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -69.96 -35.76 74.71 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.051 -175.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.43 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 11.3 tpt180 -77.04 -35.87 56.5 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.149 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -78.21 -60.11 2.5 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.676 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.5 m 170.58 87.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.758 1.623 . . . . 0.0 111.529 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -103.21 -23.83 13.6 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.199 -1.0 . . . . 0.0 109.176 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 C--O 1.25 1.125 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.795 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.954 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 48.2 m -75.38 114.24 13.7 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 115.18 -0.51 . . . . 0.0 111.148 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 20.0 mmt -95.04 159.96 14.78 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 172.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 11.6 m 63.84 24.75 13.84 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -173.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -83.18 108.01 16.13 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.906 -173.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -116.91 58.72 0.77 Allowed 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.309 174.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -90.62 52.64 3.36 Favored Glycine 0 CA--C 1.48 -2.122 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.154 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.454 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 37.4 p-10 -99.15 -1.75 38.6 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 113.813 -1.194 . . . . 0.0 110.39 -176.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER -53.4 -49.92 66.26 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -178.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 9.0 t -68.43 -27.14 65.93 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.78 -50.11 32.82 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.469 HE22 ' HB3' ' A' ' 69' ' ' ALA . 81.1 mm-40 -61.18 -44.37 97.41 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.609 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.22 -46.79 88.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.036 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.83 -41.7 78.31 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 20.8 mt -60.34 -62.16 2.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.433 176.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 11.1 t -63.76 -26.76 68.79 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -74.86 -56.29 4.92 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.856 0.36 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.1 -41.49 50.12 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.439 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 29.8 t -68.47 -54.62 15.79 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -173.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.56 -33.6 75.95 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 15.5 m -71.38 -38.64 71.5 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.726 0.298 . . . . 0.0 110.291 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -67.73 -39.36 84.29 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 44.2 t -69.31 -7.54 38.0 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-N 114.668 -1.151 . . . . 0.0 112.221 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -126.78 -54.23 1.42 Allowed 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.733 -175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -112.95 -150.3 10.77 Favored Glycine 0 N--CA 1.438 -1.228 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.88 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -91.29 5.65 80.98 Favored Glycine 0 N--CA 1.439 -1.156 0 C-N-CA 121.654 -0.308 . . . . 0.0 112.774 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -56.86 118.68 12.57 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 177.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 4.9 p -152.3 120.39 6.24 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -177.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -135.54 176.92 19.83 Favored Glycine 0 N--CA 1.419 -2.458 0 C-N-CA 119.828 -1.177 . . . . 0.0 112.549 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -141.29 174.36 22.9 Favored Glycine 0 N--CA 1.416 -2.643 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -171.72 -160.55 20.52 Favored Glycine 0 N--CA 1.427 -1.926 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.9 m 69.28 152.71 0.1 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.605 1.162 . . . . 0.0 112.892 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -175.57 58.98 0.11 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 176.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -91.86 -132.09 5.56 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.889 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 134.07 88.1 0.31 Allowed Glycine 0 N--CA 1.438 -1.194 0 N-CA-C 110.412 -1.075 . . . . 0.0 110.412 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.7 m 79.37 6.41 2.03 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 124.947 1.299 . . . . 0.0 113.516 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.417 HD22 ' HG2' ' A' ' 83' ' ' ARG . 59.2 mt -76.88 -35.14 57.64 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 173.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.576 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 1.4 mp0 -58.33 -40.77 82.99 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.189 176.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 71.4 m -70.99 -12.52 61.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.742 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -80.48 -34.9 35.47 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 92.2 mmm -80.96 -30.61 35.11 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.665 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.555 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.285 43.7 mt-10 -47.16 -27.78 1.57 Allowed 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -173.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -73.82 -49.59 24.47 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 119.156 0.889 . . . . 0.0 110.897 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -73.4 -24.4 20.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-O 122.272 1.034 . . . . 0.0 110.079 178.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.555 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.7 mm -70.75 -35.51 60.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.539 172.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.45 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 38.7 ttt180 -59.08 -40.98 86.93 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.8 m -57.68 -53.34 59.27 Favored 'General case' 0 CA--C 1.553 1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.641 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -66.06 -38.64 88.85 Favored 'General case' 0 C--N 1.345 0.399 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.474 HD22 HD21 ' A' ' 42' ' ' ASN . 4.1 pp -73.93 -31.45 63.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.436 ' N ' HD12 ' B' ' 149' ' ' LEU . 39.7 tpp -67.51 -34.94 78.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.8 t70 75.55 -50.55 0.64 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.621 1.568 . . . . 0.0 112.446 171.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.436 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.622 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.209 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.34 97.59 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.175 0 CA-C-O 123.14 1.447 . . . . 0.0 113.447 -176.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -120.01 31.31 6.58 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 113.291 -1.777 . . . . 0.0 107.049 177.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.652 ' HD3' ' CE2' ' A' ' 6' ' ' TRP . 16.0 ptpt -137.33 126.32 24.28 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 113.646 -1.615 . . . . 0.0 109.907 -171.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.6 -18.53 79.73 Favored Glycine 0 C--N 1.316 -0.572 0 N-CA-C 114.366 0.507 . . . . 0.0 114.366 -177.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.652 ' CE2' ' HD3' ' A' ' 4' ' ' LYS . 69.2 p-90 -67.27 -6.07 16.81 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -61.64 -30.65 70.85 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 120.861 0.362 . . . . 0.0 111.067 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -71.85 -21.98 61.59 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.376 0.608 . . . . 0.0 111.318 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -87.43 -33.03 19.21 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.888 -176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.532 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.6 p -87.54 110.5 20.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-O 121.993 0.901 . . . . 0.0 109.788 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -71.53 149.54 45.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.908 -176.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -37.58 82.57 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -56.79 -42.64 79.84 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.287 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.32 -52.03 21.02 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.763 0.792 . . . . 0.0 109.167 -173.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.8 ptm180 -64.48 -38.5 91.24 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.239 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 t -73.9 -23.98 59.64 Favored 'General case' 0 N--CA 1.424 -1.765 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -70.94 -37.5 72.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -64.84 -40.22 94.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.394 174.359 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 83.9 t -58.84 -45.97 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.364 0.666 . . . . 0.0 109.652 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -55.47 -47.29 76.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.173 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.649 ' HD3' HD23 ' B' ' 115' ' ' LEU . 35.7 mttp -66.21 -36.87 84.17 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.312 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 19' ' ' VAL . 60.4 mt -56.41 -45.39 80.71 Favored 'General case' 0 C--O 1.222 -0.384 0 O-C-N 123.241 0.338 . . . . 0.0 110.188 174.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -48.87 83.98 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 O-C-N 123.772 0.67 . . . . 0.0 111.813 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -71.76 -23.58 61.62 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.502 -176.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.45 -41.34 21.98 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.406 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.551 HD11 ' CG2' ' B' ' 145' ' ' ILE . 2.9 tt -70.52 -34.36 57.15 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -127.61 87.09 56.88 Favored Pre-proline 0 N--CA 1.41 -2.467 0 CA-C-N 114.881 -1.054 . . . . 0.0 113.623 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -68.06 77.3 0.62 Allowed 'Trans proline' 0 C--O 1.262 1.685 0 C-N-CA 122.5 2.133 . . . . 0.0 108.61 168.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.4 t -54.88 143.95 49.29 Favored Pre-proline 0 N--CA 1.427 -1.621 0 CA-C-N 113.444 -1.707 . . . . 0.0 113.142 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -66.32 -36.31 28.18 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.264 1.976 . . . . 0.0 110.66 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -149.03 142.13 15.77 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -53.81 -21.12 19.27 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.256 2.637 . . . . 0.0 115.307 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.83 -11.06 59.66 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 121.035 -1.041 . . . . 0.0 112.468 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.44 -12.86 60.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.181 0.991 . . . . 0.0 108.758 174.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -84.2 7.23 19.72 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.463 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -132.98 20.41 4.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.766 0.793 . . . . 0.0 109.791 175.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 35.4 t70 -86.86 174.97 8.42 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.298 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.422 ' H ' ' HD2' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -65.82 -25.22 67.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.944 0.402 . . . . 0.0 110.375 175.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.502 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.9 ttm180 -65.56 -31.37 72.38 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 10.2 tpp -60.73 -39.27 88.01 Favored 'General case' 0 CA--C 1.496 -1.128 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.099 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -33.67 76.51 Favored 'General case' 0 C--O 1.199 -1.555 0 C-N-CA 117.381 -1.727 . . . . 0.0 110.048 -177.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -66.59 -46.29 76.43 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 124.039 0.837 . . . . 0.0 110.386 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 85.8 mt -65.72 -47.05 76.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.928 -177.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.6 p -73.27 -31.87 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.1 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.09 94.98 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -60.12 -47.41 86.01 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 124.208 1.003 . . . . 0.0 110.322 174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.15 -45.24 94.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.773 -0.194 . . . . 0.0 110.738 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HE2' HG22 ' A' ' 44' ' ' VAL . 62.6 mttm -62.85 -40.04 96.24 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.881 0.472 . . . . 0.0 111.474 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 48.4 pttt -73.55 -36.37 65.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.862 0.363 . . . . 0.0 110.979 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' A' ' 54' ' ' MET . 40.5 t -67.4 -45.92 84.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -54.98 -47.85 74.03 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.831 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.77 97.1 Favored Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.793 -0.64 . . . . 0.0 113.206 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.63 -54.32 48.41 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.762 0.315 . . . . 0.0 110.962 179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.594 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 1.8 ptp -70.17 -30.88 68.13 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -60.99 -49.59 76.81 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.601 ' HA ' ' HZ2' ' A' ' 4' ' ' LYS . 6.1 mm-40 -73.3 -24.31 60.39 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.448 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 37.9 m -76.16 -34.46 59.37 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.852 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.5 164.72 14.69 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.138 0.494 . . . . 0.0 111.967 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -119.04 15.37 13.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.001 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.5 m -158.4 150.48 21.65 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.532 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.38 -34.34 67.87 Favored 'General case' 0 C--O 1.187 -2.19 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.319 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -69.39 -32.24 71.12 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.874 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.502 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 11.9 tp10 -66.56 -51.68 53.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -39.25 92.23 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.784 -177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.683 ' CE1' HD13 ' B' ' 115' ' ' LEU . 11.9 t80 -61.46 -47.13 87.09 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.145 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.601 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 55.8 m80 -70.68 -43.54 68.84 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.594 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.6 pp -68.53 -31.09 70.07 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 120.379 -0.528 . . . . 0.0 112.186 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.7 OUTLIER -74.48 -39.27 62.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.412 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.538 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -54.22 -40.82 68.0 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.681 173.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 45.7 mm-40 -60.16 -48.56 81.23 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.511 0.672 . . . . 0.0 110.577 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 1.6 tptt -62.09 -48.31 80.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.322 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.591 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -34.34 67.35 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.186 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.466 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 5.4 t80 -55.5 -53.52 55.34 Favored 'General case' 0 C--O 1.257 1.477 0 C-N-CA 125.348 1.459 . . . . 0.0 110.943 174.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.7 ptpt -64.35 -34.36 77.97 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.717 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.482 HD13 ' HD2' ' A' ' 71' ' ' LYS . 1.5 mp -63.75 -43.95 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 O-C-N 123.326 0.391 . . . . 0.0 110.49 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.8 mt-30 -64.59 -52.12 59.17 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.9 -176.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.583 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.0 ptpt -71.16 -29.05 64.72 Favored 'General case' 0 N--CA 1.419 -1.997 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.1 -177.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.642 ' O ' ' HG3' ' A' ' 82' ' ' LYS . 48.9 tp10 -63.22 -51.77 64.9 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -64.0 -39.72 94.76 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.548 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -68.52 -44.37 74.76 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.7 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -69.17 -45.15 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 119.869 -0.732 . . . . 0.0 112.199 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 78' ' ' GLU . 0.0 OUTLIER -73.57 -33.73 64.79 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -177.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.453 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 3.4 tmt_? -77.03 -41.25 43.32 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.125 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.453 ' O ' ' HB2' ' A' ' 85' ' ' SER . 59.4 ttt180 -66.32 -60.65 2.57 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.663 -178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 13.8 t 162.58 118.82 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 82' ' ' LYS . 29.6 ptt180 -139.93 -19.59 0.9 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.039 171.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 C--O 1.256 1.419 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.547 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.868 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.8 m -77.81 -51.17 10.93 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 23.7 mmt 57.64 77.68 0.27 Allowed 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 124.534 1.134 . . . . 0.0 111.235 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 13.1 t -110.23 -51.94 2.82 Favored 'General case' 0 C--N 1.311 -1.078 0 C-N-CA 119.976 -0.69 . . . . 0.0 109.27 178.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -96.11 8.63 43.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.95 0.881 . . . . 0.0 109.955 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -135.98 131.11 34.64 Favored 'General case' 0 N--CA 1.414 -2.234 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 173.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.83 -21.23 18.88 Favored Glycine 0 C--N 1.296 -1.689 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -175.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -81.27 -19.56 42.76 Favored 'General case' 0 C--N 1.281 -2.37 0 CA-C-N 113.747 -1.227 . . . . 0.0 112.414 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.496 ' HA ' ' OE1' ' B' ' 112' ' ' GLN . 4.8 pm0 -68.79 -32.59 72.43 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 41.1 m -59.12 -49.32 78.33 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.123 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.36 -53.12 48.17 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.481 -176.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.496 ' OE1' ' HA ' ' B' ' 109' ' ' GLN 0.366 0.0 OUTLIER -75.3 -27.61 59.4 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -176.552 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -73.68 -42.21 61.6 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.483 175.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.54 -45.78 90.79 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.683 HD13 ' CE1' ' A' ' 65' ' ' TYR . 9.0 mt -50.01 -61.77 1.96 Allowed 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.494 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -62.32 -42.29 99.25 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.623 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 41.9 m -63.94 -37.39 87.25 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.307 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -77.06 -53.1 8.21 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 175.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.4 m -62.31 -54.39 41.24 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -171.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 86.9 mt -74.14 -24.97 59.5 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.91 -0.716 . . . . 0.0 112.466 -174.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 17.7 m -75.87 -31.44 59.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -65.7 -50.73 63.8 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 46.0 m -59.63 -41.2 89.92 Favored 'General case' 0 C--O 1.239 0.512 0 O-C-N 123.663 0.602 . . . . 0.0 111.317 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -61.15 -43.94 98.09 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.443 0.639 . . . . 0.0 110.484 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 151.79 80.89 0.03 OUTLIER Glycine 0 N--CA 1.415 -2.703 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -151.62 163.83 30.09 Favored Glycine 0 N--CA 1.423 -2.172 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -115.59 45.55 1.28 Allowed Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.2 m -62.26 103.56 0.4 Allowed 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 123.617 0.767 . . . . 0.0 110.275 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 175.62 48.72 0.06 OUTLIER Glycine 0 N--CA 1.432 -1.58 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -137.39 94.65 0.22 Allowed Glycine 0 N--CA 1.428 -1.888 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -179.22 55.78 0.09 OUTLIER Glycine 0 C--N 1.3 -1.448 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -97.47 126.57 42.82 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 162.08 173.06 30.3 Favored Glycine 0 C--N 1.298 -1.568 0 C-N-CA 119.865 -1.16 . . . . 0.0 112.18 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 154.26 -43.87 0.59 Allowed Glycine 0 N--CA 1.432 -1.589 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 92.68 36.8 5.99 Favored Glycine 0 N--CA 1.439 -1.141 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.572 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 68.7 m 61.34 80.01 0.23 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 5.5 mp -102.56 -16.38 16.12 Favored 'General case' 0 C--O 1.245 0.855 0 CA-C-O 122.274 1.035 . . . . 0.0 108.467 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -64.88 -23.49 67.25 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.746 -1.57 . . . . 0.0 112.415 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 7.2 p -48.41 -30.33 4.92 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.747 1.219 . . . . 0.0 113.967 177.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -105.4 -14.04 15.45 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 121.837 0.827 . . . . 0.0 110.439 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.601 ' O ' HG12 ' B' ' 145' ' ' ILE . 7.7 tpt -81.0 -27.74 35.76 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.708 0.765 . . . . 0.0 109.117 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.535 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 50.4 mt-10 -52.57 -27.22 15.86 Favored 'General case' 0 C--O 1.199 -1.586 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.9 p -58.06 -59.96 4.47 Favored 'General case' 0 C--O 1.265 1.87 0 CA-C-O 122.083 0.944 . . . . 0.0 110.926 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.465 HD11 ' SD ' ' B' ' 141' ' ' MET . 41.8 pt -64.61 -29.93 48.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.61 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.601 HG12 ' O ' ' B' ' 141' ' ' MET . 17.7 mm -67.25 -40.56 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.007 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 99.1 mtt180 -59.58 -42.01 91.56 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.2 m -58.07 -47.36 83.41 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.903 175.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -70.82 -38.4 73.28 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -71.09 -31.19 67.5 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.752 -0.592 . . . . 0.0 110.369 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -76.81 -58.56 3.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.277 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -114.28 95.3 5.21 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.329 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.056 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 177.322 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.83 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.2 t -93.52 102.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.536 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -115.04 124.96 52.96 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.03 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 84.1 mttt -120.32 142.89 48.7 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 115.037 -0.983 . . . . 0.0 108.595 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.1 -28.0 57.98 Favored Glycine 0 N--CA 1.473 1.111 0 N-CA-C 114.93 0.732 . . . . 0.0 114.93 -172.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.419 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 69.4 p-90 -72.32 -9.62 58.73 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.71 -15.72 54.09 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 10.9 pt-20 -89.09 -9.3 51.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.288 0.566 . . . . 0.0 110.086 177.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.0 m-70 -96.24 4.23 52.52 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.272 0.558 . . . . 0.0 109.77 -178.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.549 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.1 t -118.46 113.0 40.52 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.412 0 N-CA-C 104.716 -2.328 . . . . 0.0 104.716 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.0 m -65.98 149.93 49.46 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.463 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -57.35 -39.98 77.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.334 0.588 . . . . 0.0 109.503 177.754 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.469 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.1 m-20 -63.96 -35.01 79.29 Favored 'General case' 0 C--O 1.196 -1.719 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.04 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.39 -51.44 15.02 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' O ' HG23 ' A' ' 19' ' ' VAL . 11.9 ptm180 -59.41 -42.74 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.106 0.479 . . . . 0.0 111.278 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.435 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 21.2 t -73.0 -24.84 60.8 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.36 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.592 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 10.3 t60 -74.94 -34.8 62.13 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.339 0.59 . . . . 0.0 109.749 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.494 HD23 HD21 ' A' ' 68' ' ' LEU . 2.0 mp -63.82 -39.14 93.53 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 173.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.8 t -59.05 -49.68 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-O 121.667 0.746 . . . . 0.0 109.464 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.461 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 28.5 t-80 -51.29 -49.46 61.24 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.925 1.29 . . . . 0.0 111.098 177.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 55.2 mttm -64.77 -36.87 85.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.395 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 91.8 mt -56.1 -47.51 77.92 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.389 0.431 . . . . 0.0 110.222 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.88 -49.15 84.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 O-C-N 123.769 0.668 . . . . 0.0 112.007 176.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -70.0 -23.21 63.11 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.449 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.591 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.2 -44.23 18.13 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 116.73 -0.213 . . . . 0.0 111.472 176.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.609 HD11 HG23 ' B' ' 145' ' ' ILE . 4.9 tt -70.73 -32.99 51.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.477 0.656 . . . . 0.0 110.149 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 1.2 m-85 -127.62 93.57 39.98 Favored Pre-proline 0 N--CA 1.416 -2.155 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.1 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.566 ' O ' ' HA3' ' B' ' 133' ' ' GLY . 28.3 Cg_endo -66.86 96.42 0.37 Allowed 'Trans proline' 0 N--CA 1.446 -1.32 0 C-N-CA 121.794 1.663 . . . . 0.0 108.141 170.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 11.0 t -74.35 139.17 75.01 Favored Pre-proline 0 N--CA 1.419 -1.978 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.992 -171.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 -28.62 5.83 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.241 2.627 . . . . 0.0 111.717 176.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -140.23 146.23 44.99 Favored Pre-proline 0 CA--C 1.483 -1.629 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 -177.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -67.26 -12.58 36.43 Favored 'Trans proline' 0 C--N 1.323 -0.774 0 C-N-CA 121.411 1.408 . . . . 0.0 110.787 174.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.15 57.65 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.745 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -77.84 -11.8 59.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.101 0.953 . . . . 0.0 108.654 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.542 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.8 mt -87.79 3.82 46.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.828 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -133.04 21.52 4.11 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.697 0.761 . . . . 0.0 109.532 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.562 ' O ' ' HB3' ' A' ' 40' ' ' MET . 17.4 t70 -89.08 172.24 9.25 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.716 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.538 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.23 -25.76 65.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.419 0.628 . . . . 0.0 110.928 -178.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 -76.74 -16.21 59.55 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.613 0.72 . . . . 0.0 109.56 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.562 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.5 tpp -65.5 -40.31 92.9 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.182 176.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.5 pt-20 -62.09 -27.88 69.22 Favored 'General case' 0 C--O 1.192 -1.921 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.055 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.48 -47.41 55.67 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.196 0.598 . . . . 0.0 110.565 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.25 -45.96 75.15 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.426 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -72.6 -30.74 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.141 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.43 94.85 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.6 t80 -56.92 -46.59 81.89 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.675 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.78 -47.8 81.91 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.441 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -62.59 -40.11 95.85 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.14 0.576 . . . . 0.0 112.362 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.8 pttp -72.51 -38.32 68.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.809 0.338 . . . . 0.0 110.681 -177.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.6 t -69.28 -47.08 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -58.71 -47.6 84.02 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 123.663 0.785 . . . . 0.0 109.34 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.51 -39.73 93.49 Favored Glycine 0 C--O 1.224 -0.507 0 O-C-N 123.644 0.59 . . . . 0.0 112.667 178.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -59.84 -54.75 42.56 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.946 0.403 . . . . 0.0 111.19 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.46 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -66.74 -32.54 73.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.382 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.29 -49.78 76.25 Favored 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 123.902 0.881 . . . . 0.0 109.706 173.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.43 -21.08 60.56 Favored 'General case' 0 C--N 1.31 -1.152 0 O-C-N 122.033 -0.417 . . . . 0.0 111.986 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -84.55 -39.46 18.76 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.63 169.76 15.91 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -174.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.35 6.49 16.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.685 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -164.34 151.57 11.71 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.549 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -63.46 -35.77 81.54 Favored 'General case' 0 C--O 1.178 -2.676 0 C-N-CA 119.091 -1.043 . . . . 0.0 111.141 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -63.17 -36.15 82.66 Favored 'General case' 0 C--N 1.313 -1.018 0 O-C-N 123.923 0.764 . . . . 0.0 110.379 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -71.81 -46.66 57.43 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.826 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -40.42 95.81 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.523 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.433 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.3 OUTLIER -56.15 -49.91 72.65 Favored 'General case' 0 C--O 1.209 -1.045 0 C-N-CA 125.13 1.372 . . . . 0.0 109.369 174.499 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.439 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 35.9 t-80 -64.58 -54.16 36.39 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.419 -172.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.459 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.82 -29.97 69.26 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.447 -177.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.494 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -74.02 -38.26 64.11 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.725 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.7 -32.34 73.41 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 123.398 0.437 . . . . 0.0 109.838 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 12.1 mm-40 -70.85 -41.56 71.29 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.221 176.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -37.59 66.65 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 118.954 -1.098 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.7 tt -66.54 -36.32 77.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.54 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.85 -54.12 38.92 Favored 'General case' 0 C--O 1.252 1.205 0 C-N-CA 125.004 1.321 . . . . 0.0 111.269 174.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -67.91 -34.81 77.35 Favored 'General case' 0 C--O 1.215 -0.748 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.911 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.97 -42.81 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 123.558 0.536 . . . . 0.0 110.476 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.4 mt-30 -61.82 -57.02 13.43 Favored 'General case' 0 CA--C 1.484 -1.567 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.081 -178.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.6 ptpt -66.23 -32.5 73.96 Favored 'General case' 0 N--CA 1.418 -2.057 0 C-N-CA 119.78 -0.768 . . . . 0.0 112.839 -176.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -59.45 -52.68 64.56 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -68.2 -41.7 80.96 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.964 -177.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.7 -43.34 99.05 Favored 'General case' 0 C--O 1.246 0.909 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.6 pt-20 -75.5 -36.66 60.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.657 -177.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' B' ' 140' ' ' ASP . 0.0 OUTLIER -71.5 -28.37 63.87 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -77.0 -43.12 35.93 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.807 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -75.67 -61.03 2.06 Favored 'General case' 0 C--O 1.247 0.959 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.446 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p 168.96 90.37 0.0 OUTLIER 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.854 0.862 . . . . 0.0 111.652 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.451 ' HD2' ' HB3' ' A' ' 82' ' ' LYS . 8.1 ptm180 -108.83 -23.38 11.77 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--O 1.256 1.418 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.434 -179.621 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.705 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 4.7 p -86.51 120.17 27.55 Favored 'General case' 0 N--CA 1.426 -1.671 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.5 ptm -106.82 -6.36 17.76 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.12 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.6 m 54.23 64.66 1.75 Allowed 'General case' 0 C--O 1.243 0.745 0 O-C-N 124.126 0.891 . . . . 0.0 110.185 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -76.49 107.99 9.15 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 121.873 0.844 . . . . 0.0 112.177 -175.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -150.58 120.45 7.11 Favored 'General case' 0 N--CA 1.426 -1.635 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.858 178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.46 -25.32 6.46 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -107.28 -10.58 15.77 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 -173.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -60.54 -37.57 81.63 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 123.517 0.51 . . . . 0.0 110.442 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 1.7 t -59.15 -48.44 81.6 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.005 177.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.42 -48.29 56.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -60.66 -43.76 97.26 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.291 0.369 . . . . 0.0 111.107 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.71 -38.58 80.35 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.176 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 110' ' ' THR . 81.7 mt -63.16 -38.89 92.97 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.294 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -56.7 -66.58 0.42 Allowed 'General case' 0 C--O 1.214 -0.808 0 O-C-N 123.362 0.414 . . . . 0.0 110.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.433 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 9.0 t -56.96 -46.94 81.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -173.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.1 t -72.21 -46.82 54.6 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.994 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -76.58 -36.34 57.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.542 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 72.6 p -62.66 -48.86 77.51 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.87 -15.28 59.75 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.478 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 17.0 t -76.86 -58.19 3.42 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.286 0.565 . . . . 0.0 109.745 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -76.35 -38.88 55.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.867 -178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 16.8 m 63.7 -84.59 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.023 1.329 . . . . 0.0 113.276 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.12 -39.1 85.09 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.235 0.614 . . . . 0.0 112.139 -176.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 177.44 -65.81 0.09 OUTLIER Glycine 0 CA--C 1.486 -1.739 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.93 -85.49 1.56 Allowed Glycine 0 N--CA 1.428 -1.896 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.628 177.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 163.24 -113.71 0.57 Allowed Glycine 0 N--CA 1.42 -2.41 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.356 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 38.3 m 67.33 27.88 8.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.551 1.14 . . . . 0.0 110.446 -176.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -132.76 41.41 1.49 Allowed Glycine 0 N--CA 1.436 -1.348 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.807 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.68 -24.17 77.15 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.667 -0.267 . . . . 0.0 112.882 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 145.16 107.03 0.53 Allowed Glycine 0 N--CA 1.433 -1.555 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.515 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 55.8 m -150.48 31.87 0.65 Allowed 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.593 0.711 . . . . 0.0 109.44 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . 0.566 ' HA3' ' O ' ' A' ' 28' ' ' PRO . . . -150.45 49.7 0.55 Allowed Glycine 0 N--CA 1.435 -1.408 0 N-CA-C 110.126 -1.189 . . . . 0.0 110.126 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -80.25 74.31 2.35 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 -178.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 155.41 -174.68 33.49 Favored Glycine 0 N--CA 1.422 -2.282 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 7.3 p -89.93 96.29 10.61 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 117.661 0.73 . . . . 0.0 111.227 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.41 -51.26 3.05 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.263 1.03 . . . . 0.0 108.754 178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -16.91 58.58 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.851 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 46.1 t -51.57 -46.26 63.38 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.338 0.655 . . . . 0.0 111.951 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . 0.477 ' HB2' ' HE3' ' A' ' 82' ' ' LYS . 16.8 m-20 -82.1 -23.83 35.52 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.144 0.497 . . . . 0.0 111.103 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.624 ' SD ' HD11 ' B' ' 144' ' ' ILE . 13.9 tpt -76.38 -30.45 57.54 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.295 0.569 . . . . 0.0 109.617 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.599 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.4 mt-10 -49.66 -26.46 3.71 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.3 p -60.31 -59.47 5.36 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 121.362 0.601 . . . . 0.0 111.534 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.624 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.6 pp -70.78 -24.94 25.4 Favored 'Isoleucine or valine' 0 C--O 1.264 1.826 0 CA-C-O 122.28 1.038 . . . . 0.0 111.469 177.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.609 HG23 HD11 ' A' ' 26' ' ' ILE . 15.2 mm -65.1 -39.29 85.1 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.201 172.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -65.52 -40.7 93.27 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.885 177.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 5.2 p -60.75 -28.87 69.03 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 119.487 -0.885 . . . . 0.0 111.919 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -79.56 -52.23 8.27 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 119.13 -1.028 . . . . 0.0 112.198 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 2.4 pp -72.88 -23.12 60.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 17.0 tpt -76.17 -22.7 55.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 109.928 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -94.88 167.92 11.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.422 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.729 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.8 m -73.77 155.97 6.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.458 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -111.0 71.47 0.74 Allowed 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 122.595 1.188 . . . . 0.0 110.582 176.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.521 ' HD3' ' CZ2' ' A' ' 6' ' ' TRP . 16.1 ptpt -162.41 101.28 1.07 Allowed 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.692 -178.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.57 -15.64 47.59 Favored Glycine 0 N--CA 1.468 0.782 0 N-CA-C 115.578 0.991 . . . . 0.0 115.578 -172.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.521 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 67.5 p-90 -67.46 -9.2 39.68 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 112.314 0.486 . . . . 0.0 112.314 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -67.09 -17.73 65.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.188 0.518 . . . . 0.0 110.765 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.87 -10.0 59.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 121.243 0.544 . . . . 0.0 109.794 176.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.442 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 15.6 m-70 -96.72 4.55 51.76 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.48 -178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.467 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -138.09 110.66 6.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-O 122.068 0.937 . . . . 0.0 109.363 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -86.63 162.92 17.7 Favored 'General case' 0 N--CA 1.414 -2.245 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.788 -177.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.85 -36.85 77.71 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.754 -178.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' B' ' 122' ' ' HIS . 2.6 p30 -57.25 -45.5 83.93 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' B' ' 119' ' ' SER . 3.3 tm? -69.61 -50.98 39.24 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.718 0.771 . . . . 0.0 108.945 -175.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.544 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.5 ptm180 -66.41 -41.35 89.4 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.064 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.404 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 14.5 t -70.79 -25.36 62.85 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 46.9 t60 -67.66 -40.55 84.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.517 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -65.32 -36.12 83.06 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.078 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -59.55 -44.73 93.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 123.521 0.728 . . . . 0.0 109.358 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.44 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.8 t-80 -58.77 -42.34 88.71 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.127 176.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.612 ' HD3' HD23 ' B' ' 115' ' ' LEU . 72.7 mttt -71.27 -36.32 71.68 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.1 mt -57.02 -44.09 82.49 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 2.9 t -58.01 -50.41 78.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 O-C-N 124.117 0.886 . . . . 0.0 111.827 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.65 -17.67 62.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.62 -46.33 13.42 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.452 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.654 HD11 HG23 ' B' ' 145' ' ' ILE . 4.4 tt -70.69 -36.79 66.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 122.05 0.929 . . . . 0.0 108.925 -177.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 5.5 m-85 -130.16 88.06 49.27 Favored Pre-proline 0 N--CA 1.397 -3.087 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.624 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -61.6 94.44 0.12 Allowed 'Trans proline' 0 N--CA 1.438 -1.74 0 C-N-CA 121.878 1.719 . . . . 0.0 108.489 173.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -68.72 136.75 90.26 Favored Pre-proline 0 N--CA 1.401 -2.923 0 CA-C-N 113.883 -1.508 . . . . 0.0 111.68 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.18 -32.52 4.06 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 122.511 2.141 . . . . 0.0 110.612 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -137.46 146.27 52.88 Favored Pre-proline 0 CA--C 1.482 -1.659 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.122 -174.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -68.5 -11.45 31.98 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.626 1.551 . . . . 0.0 111.446 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.88 -9.23 54.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.57 -13.41 59.92 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.3 mt -84.53 7.24 20.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 113.921 -1.49 . . . . 0.0 110.612 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.87 14.04 4.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.756 0.789 . . . . 0.0 109.613 176.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.6 t70 -81.16 171.04 15.38 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.526 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.435 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.18 -28.57 69.84 Favored 'General case' 0 C--N 1.31 -1.129 0 O-C-N 122.14 -0.35 . . . . 0.0 111.289 -179.157 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.481 ' HD3' ' CE2' ' A' ' 27' ' ' PHE . 19.7 ttm180 -70.3 -20.16 63.04 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.574 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.7 tpp -63.84 -42.87 97.5 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.444 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.48 -33.87 73.22 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.86 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -68.69 -48.21 64.48 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 84.7 mt -67.48 -42.08 83.53 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.032 -178.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.574 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.0 p -73.09 -33.55 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -62.07 -48.82 78.49 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 175.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.59 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 1.7 t80 -56.28 -42.89 78.21 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.099 0.96 . . . . 0.0 110.512 174.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -69.14 -38.46 78.83 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.986 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.3 mttm -64.36 -39.57 94.14 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 120.67 0.271 . . . . 0.0 111.364 177.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 4.3 ptmt -68.0 -44.14 77.25 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.477 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.2 t -62.32 -50.44 79.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.616 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.8 tm-20 -56.31 -50.06 72.53 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.371 1.068 . . . . 0.0 109.26 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.78 -32.78 80.35 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.137 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -70.07 -49.34 52.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.932 0.396 . . . . 0.0 110.732 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.427 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -65.8 -30.33 70.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 177.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.468 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 78.1 t80 -61.75 -42.35 98.85 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HA ' ' OE1' ' A' ' 56' ' ' GLU . 3.4 mm-40 -82.03 -13.27 57.61 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.3 t -87.63 -27.14 22.67 Favored 'General case' 0 C--N 1.287 -2.132 0 CA-C-O 121.105 0.479 . . . . 0.0 110.56 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -95.55 165.83 12.15 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -116.54 8.52 13.98 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.709 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.0 p -158.42 156.66 30.81 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.572 -1.269 . . . . 0.0 107.572 173.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -32.94 67.35 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.853 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.78 -37.63 88.27 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 178.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -64.96 -47.47 77.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.903 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -40.99 98.32 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.048 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.697 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 7.0 t80 -64.01 -42.98 96.98 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.161 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.505 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.4 m80 -62.77 -57.21 11.73 Favored 'General case' 0 C--O 1.202 -1.423 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.05 176.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.1 pp -64.23 -30.22 71.29 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -173.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.511 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -72.36 -46.51 55.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 175.606 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.512 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -53.86 -34.27 58.88 Favored 'General case' 0 C--O 1.207 -1.16 0 O-C-N 123.825 0.703 . . . . 0.0 110.809 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.707 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 14.1 mt-10 -74.09 -45.35 49.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -67.72 -37.69 82.58 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 119.675 -0.81 . . . . 0.0 108.944 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 2.4 tt -69.31 -35.67 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.707 ' CD2' ' HA ' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -69.45 -38.54 77.82 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.286 -178.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -68.19 -33.29 74.16 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.386 0.428 . . . . 0.0 110.068 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.66 -41.45 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.066 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 49.7 mt-30 -65.37 -45.43 84.12 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 120.957 0.408 . . . . 0.0 110.617 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.5 ptpt -71.41 -26.98 62.99 Favored 'General case' 0 N--CA 1.424 -1.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.72 -47.02 73.66 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -66.38 -34.42 77.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.084 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -65.66 -53.32 42.96 Favored 'General case' 0 N--CA 1.407 -2.579 0 C-N-CA 124.007 0.923 . . . . 0.0 110.314 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -62.29 -38.18 88.38 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -71.51 -31.16 66.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.026 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' HA ' ' NE ' ' A' ' 83' ' ' ARG . 1.0 OUTLIER -77.12 -42.45 37.9 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 85' ' ' SER . 23.2 ttm180 -57.87 -60.26 3.98 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 124.248 0.968 . . . . 0.0 110.273 -175.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 29.4 t 153.78 91.7 0.0 OUTLIER 'General case' 0 C--N 1.36 1.029 0 C-N-CA 125.501 1.52 . . . . 0.0 109.354 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.501 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 40.1 ptt180 -109.55 -24.57 10.91 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.972 174.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 86' ' ' ARG . 3.8 mm? . . . . . 0 C--N 1.314 -0.957 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.608 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 25.0 m -154.04 159.27 41.49 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 95.8 mmm -115.88 94.44 4.67 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 5.1 p -88.91 15.88 7.81 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.192 -176.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -135.58 143.02 45.42 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -83.91 88.39 7.13 Favored 'General case' 0 CA--C 1.481 -1.689 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.43 84.16 0.01 OUTLIER Glycine 0 N--CA 1.437 -1.293 0 CA-C-N 113.329 -1.76 . . . . 0.0 115.504 -172.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -121.24 -17.74 7.59 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 121.762 0.792 . . . . 0.0 109.47 169.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.47 ' H ' ' CD ' ' B' ' 109' ' ' GLN . 18.8 mp0 -64.84 -49.47 70.44 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.562 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 30.2 m -55.62 -45.93 77.45 Favored 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 114.001 -1.454 . . . . 0.0 110.617 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.93 -51.98 16.4 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.535 -173.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -67.52 -36.73 81.6 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.517 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.69 -46.36 82.71 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.006 0.432 . . . . 0.0 110.112 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.0 tp -60.83 -44.78 96.48 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.261 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.697 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 21.9 mt -55.09 -67.29 0.28 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.856 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 13.7 t -58.0 -28.91 64.85 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 21.8 p -73.97 -52.6 12.31 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.809 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.529 ' HB2' ' NZ ' ' A' ' 21' ' ' LYS . 53.6 m-20 -76.21 -43.74 40.88 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 119.154 -1.018 . . . . 0.0 112.319 -177.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.469 ' HB3' HD22 ' A' ' 14' ' ' LEU . 20.1 m -56.5 -54.02 50.66 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.547 0.689 . . . . 0.0 111.705 -173.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.54 -11.13 60.13 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.451 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 32.1 t -71.26 -24.73 62.22 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . 0.419 ' CE1' ' HA2' ' B' ' 127' ' ' GLY . 31.8 m-70 -73.43 -22.86 60.11 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.882 0.849 . . . . 0.0 109.667 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.2 t -91.82 12.23 22.16 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -127.15 -53.12 1.4 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.48 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 157.0 101.75 0.18 Allowed Glycine 0 N--CA 1.434 -1.446 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.77 178.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 141.08 142.01 4.07 Favored Glycine 0 N--CA 1.436 -1.341 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.351 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . 0.419 ' HA2' ' CE1' ' B' ' 122' ' ' HIS . . . -96.03 82.67 0.81 Allowed Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.7 m -63.63 111.94 2.6 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 123.673 0.789 . . . . 0.0 112.209 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -101.26 -123.92 5.28 Favored Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.17 159.69 10.6 Favored Glycine 0 C--N 1.305 -1.147 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -105.97 -179.17 23.52 Favored Glycine 0 C--N 1.307 -1.061 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -130.81 -49.2 1.04 Allowed 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.384 -0.927 . . . . 0.0 110.954 -176.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 115.95 92.35 1.76 Allowed Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -83.69 133.56 11.98 Favored Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 111.521 -0.632 . . . . 0.0 111.521 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -158.72 35.42 0.5 Allowed Glycine 0 N--CA 1.436 -1.365 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.0 m 59.11 67.38 0.92 Allowed 'General case' 0 C--O 1.245 0.818 0 CA-C-O 122.751 1.262 . . . . 0.0 112.482 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' B' ' 141' ' ' MET . 2.8 mm? -104.5 -26.63 12.31 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.543 175.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -90.35 -43.24 10.46 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -169.064 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 62.2 m -52.26 -38.43 58.19 Favored 'General case' 0 CA--C 1.558 1.261 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -173.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -96.14 -11.95 25.46 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 121.607 -0.683 . . . . 0.0 111.025 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.498 ' SD ' ' HE2' ' A' ' 82' ' ' LYS . 11.9 tpt -81.33 -22.43 38.48 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.603 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -50.89 -27.13 6.83 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.0 m -58.78 -53.53 57.38 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-O 121.053 0.454 . . . . 0.0 110.681 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . 0.25 2.7 pp -73.92 -24.17 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 121.164 0.506 . . . . 0.0 111.147 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.654 HG23 HD11 ' A' ' 26' ' ' ILE . 13.8 mm -65.17 -42.52 94.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.081 172.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.474 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 49.0 ttp180 -62.08 -37.67 85.91 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.674 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.2 m -56.55 -53.89 52.28 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 123.662 0.601 . . . . 0.0 110.224 172.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.2 -41.54 90.05 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.474 ' HG ' ' HA ' ' B' ' 146' ' ' ARG 0.268 3.4 pp -68.29 -31.23 70.53 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.57 -0.707 . . . . 0.0 111.764 -178.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.5 ttt -77.05 -54.93 5.92 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.454 177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -105.24 120.74 42.29 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.101 0.477 . . . . 0.0 111.95 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.025 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.853 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.787 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.6 m -125.56 148.94 30.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.69 116.41 24.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 121.734 0.778 . . . . 0.0 112.02 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 12.3 ptpt -154.17 112.21 3.53 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.75 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.26 -8.17 22.89 Favored Glycine 0 N--CA 1.47 0.912 0 N-CA-C 116.424 1.33 . . . . 0.0 116.424 -170.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.403 ' CZ2' ' HD3' ' A' ' 4' ' ' LYS . 70.4 p-90 -79.9 -3.0 46.18 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 121.543 -0.975 . . . . 0.0 110.027 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.545 ' HB2' ' O ' ' A' ' 4' ' ' LYS . 8.8 t-80 -60.84 -32.34 71.74 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 125.936 1.695 . . . . 0.0 108.809 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -81.71 -4.26 55.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.147 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -109.23 -15.67 14.24 Favored 'General case' 0 CA--C 1.499 -1.002 0 CA-C-O 121.3 0.571 . . . . 0.0 111.627 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 7.5 p -101.98 109.8 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.179 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -81.22 150.5 28.58 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.795 -1.093 . . . . 0.0 110.256 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.21 -39.96 73.29 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 123.542 0.526 . . . . 0.0 110.146 177.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -64.07 -33.58 76.08 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.859 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.72 -48.08 34.64 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 8.3 ptm180 -69.8 -41.49 74.97 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.276 -177.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.7 t -70.18 -23.09 62.91 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.484 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 18.8 t60 -71.07 -42.37 69.5 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 68' ' ' LEU . 1.9 mp -62.06 -38.25 88.07 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.463 176.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 93.8 t -60.31 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.19 0.596 . . . . 0.0 109.505 172.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -52.96 -46.61 68.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.699 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.484 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 61.5 mttm -65.66 -39.47 91.4 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.7 mt -55.31 -45.5 76.32 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.358 0.411 . . . . 0.0 110.142 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.9 t -60.49 -55.01 27.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 O-C-N 123.852 0.72 . . . . 0.0 111.187 175.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.04 -26.74 68.42 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -176.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.52 -45.84 15.35 Favored 'General case' 0 C--O 1.206 -1.228 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.576 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.541 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.2 tt -70.43 -28.35 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 121.952 0.882 . . . . 0.0 109.639 -177.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.1 86.5 51.22 Favored Pre-proline 0 N--CA 1.394 -3.25 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.445 -177.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.76 98.49 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.399 0 C-N-CA 122.244 1.963 . . . . 0.0 107.413 168.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 t -73.61 142.86 81.32 Favored Pre-proline 0 N--CA 1.408 -2.546 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.653 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.53 -24.74 7.31 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.385 2.056 . . . . 0.0 111.435 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -155.7 142.61 13.55 Favored Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -174.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.31 -24.68 61.25 Favored 'Trans proline' 0 C--N 1.321 -0.873 0 C-N-CA 122.73 2.287 . . . . 0.0 114.659 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.33 -8.11 58.83 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.248 -0.908 . . . . 0.0 111.936 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.2 -11.39 59.82 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.733 0.777 . . . . 0.0 109.185 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.7 mt -87.73 3.49 47.83 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.262 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.0 19.22 4.1 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 122.534 1.159 . . . . 0.0 109.169 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.0 t70 -83.34 177.77 8.35 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.055 -1.429 . . . . 0.0 110.092 -177.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.29 -33.26 71.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.123 0.487 . . . . 0.0 110.158 179.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -69.21 -20.33 63.98 Favored 'General case' 0 C--O 1.248 0.999 0 CA-C-O 122.112 0.958 . . . . 0.0 109.935 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.607 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -62.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.696 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 38' ' ' ARG . 0.2 OUTLIER -62.39 -32.77 73.64 Favored 'General case' 0 C--O 1.174 -2.895 0 C-N-CA 118.144 -1.422 . . . . 0.0 110.785 -178.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.21 -47.98 66.43 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.591 0.557 . . . . 0.0 110.872 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.6 -44.64 77.62 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.863 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.607 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 8.7 p -73.46 -32.72 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.027 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.45 94.58 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.629 0.728 . . . . 0.0 109.094 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.497 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.6 t80 -58.56 -47.09 85.38 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.496 174.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.01 98.17 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.801 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 94.1 mttt -63.24 -44.0 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.106 0.563 . . . . 0.0 111.315 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.5 pttp -68.46 -39.42 81.43 Favored 'General case' 0 C--O 1.25 1.095 0 CA-C-O 121.307 0.575 . . . . 0.0 110.605 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.42 -50.83 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.687 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -56.71 -48.51 77.55 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.142 0.977 . . . . 0.0 109.668 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.97 -40.24 93.01 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.38 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -61.52 -55.25 33.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-O 120.336 0.112 . . . . 0.0 110.879 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -64.75 -28.61 69.7 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.735 0.642 . . . . 0.0 112.735 179.743 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -64.53 -51.68 61.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -70.64 -24.42 62.71 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.62 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.428 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 64.9 m -82.29 -33.61 29.0 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -84.5 164.75 18.61 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.326 0.584 . . . . 0.0 112.422 -176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -113.15 13.6 19.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.402 0.62 . . . . 0.0 111.351 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.6 p -163.78 153.9 15.16 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 171.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -70.36 -33.67 71.72 Favored 'General case' 0 C--O 1.188 -2.177 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.312 -178.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -64.97 -35.82 82.41 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -67.07 -46.91 72.87 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.286 175.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.63 -44.82 95.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.773 0.671 . . . . 0.0 109.609 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.77 -49.33 75.61 Favored 'General case' 0 C--O 1.208 -1.125 0 C-N-CA 125.077 1.351 . . . . 0.0 109.492 175.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -63.5 -49.61 72.87 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.62 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.5 pp -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.628 -176.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.06 -36.89 58.82 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 177.444 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.613 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -36.56 84.14 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.02 -47.29 83.71 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 121.633 0.73 . . . . 0.0 110.954 174.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -44.38 93.98 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.5 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.613 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.9 tt -69.58 -35.77 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.374 -177.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.549 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.46 -54.25 43.44 Favored 'General case' 0 C--O 1.26 1.625 0 C-N-CA 124.525 1.13 . . . . 0.0 110.936 175.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.15 -32.4 73.48 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.374 -176.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.24 -45.71 92.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.821 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.636 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 36.4 mt-30 -59.28 -53.83 53.75 Favored 'General case' 0 CA--C 1.481 -1.705 0 O-C-N 123.798 0.686 . . . . 0.0 111.364 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.648 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.6 ptpt -67.7 -35.22 78.41 Favored 'General case' 0 N--CA 1.415 -2.21 0 C-N-CA 119.192 -1.003 . . . . 0.0 112.524 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 12.0 tp10 -59.98 -48.86 79.96 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.649 ' HB2' ' OE1' ' B' ' 138' ' ' GLU . 4.6 pp -67.11 -43.77 81.64 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.6 -49.85 69.49 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 123.28 0.362 . . . . 0.0 111.356 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -68.36 -31.74 71.33 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -72.92 -34.28 66.5 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.107 -0.637 . . . . 0.0 111.45 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HG2' HD22 ' B' ' 137' ' ' LEU . 12.2 tpt180 -76.27 -36.94 58.18 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 119.751 -0.78 . . . . 0.0 109.076 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -59.52 -43.44 93.43 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.6 t 76.77 85.41 0.08 Allowed 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.443 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.8 ptt180 -99.69 -11.36 20.96 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.271 176.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 C--O 1.245 0.825 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.469 -175.304 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.758 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.1 m -90.63 88.55 7.16 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-O 121.196 0.522 . . . . 0.0 111.59 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -88.07 72.13 9.22 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 170.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.7 t -80.05 94.7 6.0 Favored 'General case' 0 N--CA 1.403 -2.78 0 CA-C-N 112.848 -1.978 . . . . 0.0 111.909 -169.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -102.15 -8.4 21.4 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.228 173.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.448 ' HA ' ' HG2' ' B' ' 109' ' ' GLN . 72.1 t80 -148.98 151.81 35.22 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.04 -32.75 7.16 Favored Glycine 0 CA--C 1.499 -0.965 0 N-CA-C 110.28 -1.128 . . . . 0.0 110.28 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.604 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 40.9 p-10 -100.07 -0.41 39.13 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.277 -0.961 . . . . 0.0 109.844 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.448 ' HG2' ' HA ' ' B' ' 106' ' ' TYR . 32.3 mm-40 -63.62 -27.91 69.56 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.248 -174.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 5.3 t -66.25 -44.3 84.08 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.037 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.54 -42.82 67.43 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.973 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.604 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 7.3 mm100 -62.57 -35.31 79.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -66.52 -44.47 82.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.056 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 110' ' ' THR . 71.8 mt -60.5 -42.73 96.94 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.041 0.448 . . . . 0.0 109.795 177.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.435 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 3.1 mm? -53.63 -59.02 5.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.686 175.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 19.4 m -60.93 -44.14 97.64 Favored 'General case' 0 C--O 1.247 0.929 0 O-C-N 123.858 0.724 . . . . 0.0 111.347 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' B' ' 121' ' ' SER . 44.7 m -62.9 -46.66 86.77 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.537 -174.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.432 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 17.2 m-20 -76.22 -41.36 49.55 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 118.556 -1.258 . . . . 0.0 111.835 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' B' ' 123' ' ' SER . 53.7 p -69.2 -54.9 12.43 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -173.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.0 mt -82.75 -49.94 9.22 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' B' ' 117' ' ' SER . 14.6 m -73.73 -38.42 64.78 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -175.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -102.32 -30.1 11.27 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.531 ' HA ' ' O ' ' B' ' 119' ' ' SER . 22.7 m 73.03 -51.84 0.71 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.308 1.443 . . . . 0.0 112.777 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -89.19 -40.34 12.94 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 89.53 175.05 46.02 Favored Glycine 0 CA--C 1.499 -0.923 0 CA-C-N 115.41 -0.814 . . . . 0.0 113.294 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 89.03 -78.83 1.65 Allowed Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.409 175.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 70.34 -103.88 1.25 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.9 m -100.56 91.76 4.81 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 172.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -129.74 -96.46 0.79 Allowed Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 86.63 -49.88 4.11 Favored Glycine 0 C--N 1.301 -1.4 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 152.15 155.24 6.95 Favored Glycine 0 N--CA 1.429 -1.828 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.2 t -135.11 5.28 3.28 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 121.8 0.809 . . . . 0.0 109.425 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -135.86 -142.48 4.52 Favored Glycine 0 N--CA 1.435 -1.384 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.598 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -164.32 156.38 28.25 Favored Glycine 0 N--CA 1.423 -2.192 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -72.77 -24.97 75.12 Favored Glycine 0 CA--C 1.499 -0.927 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 3.5 p -63.31 -37.54 87.66 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 123.634 0.774 . . . . 0.0 110.721 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.459 HD22 ' HG2' ' A' ' 83' ' ' ARG . 72.9 mt -61.7 -49.07 77.94 Favored 'General case' 0 C--O 1.254 1.313 0 CA-C-O 121.796 0.808 . . . . 0.0 109.661 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.649 ' OE1' ' HB2' ' A' ' 79' ' ' LEU 0.384 28.4 mm-40 -83.28 -9.53 59.06 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -172.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . 0.64 ' HA ' ' OE2' ' B' ' 142' ' ' GLU . 45.5 t -58.28 -22.87 54.36 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-O 121.762 0.791 . . . . 0.0 109.734 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.43 -32.86 54.88 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.304 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 144' ' ' ILE . 10.8 tpt -80.72 -23.02 39.77 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 123.894 0.877 . . . . 0.0 108.773 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.64 ' OE2' ' HA ' ' B' ' 139' ' ' CYS . 39.2 mt-10 -47.53 -26.17 1.34 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.2 m -55.94 -59.26 5.15 Favored 'General case' 0 C--O 1.259 1.599 0 CA-C-O 121.701 0.762 . . . . 0.0 111.138 174.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' B' ' 141' ' ' MET 0.291 2.6 pp -72.52 -23.59 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 O-C-N 121.356 -0.84 . . . . 0.0 111.674 178.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.633 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 29.2 mm -67.39 -38.55 80.99 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.801 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.675 172.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.433 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 15.2 tpp180 -59.14 -43.96 92.04 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.2 m -58.37 -48.16 81.51 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.598 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -72.07 -37.35 69.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.433 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.9 pp -68.34 -24.58 64.83 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.332 -0.855 . . . . 0.0 110.27 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.3 tpt -81.97 -61.45 1.91 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 173.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -120.62 108.46 14.06 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.958 0.409 . . . . 0.0 111.588 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.375 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 176.992 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.484 -1.903 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.06 121.6 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.68 0.752 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.513 ' HD2' ' H ' ' A' ' 3' ' ' ARG 0.272 0.2 OUTLIER -77.97 68.03 3.94 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.811 1.291 . . . . 0.0 112.906 -178.914 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.59 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 51.0 mtmt -141.92 90.13 2.24 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 105.289 -2.115 . . . . 0.0 105.289 176.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.13 -14.58 40.2 Favored Glycine 0 C--N 1.319 -0.415 0 N-CA-C 114.404 0.521 . . . . 0.0 114.404 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.59 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 65.4 p-90 -63.91 -19.89 65.44 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.409 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 5.3 p80 -61.94 -20.72 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.277 0.56 . . . . 0.0 111.393 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -82.5 -10.78 58.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -108.58 8.31 27.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.867 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.434 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -129.66 118.54 45.35 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 CA-C-O 121.317 0.579 . . . . 0.0 110.043 -177.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -85.8 153.1 22.51 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.287 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -38.29 70.09 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-O 121.016 0.436 . . . . 0.0 110.765 177.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.506 ' CB ' ' HA ' ' B' ' 124' ' ' ASP . 7.2 m-20 -69.73 -27.72 65.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.434 HD12 HG23 ' A' ' 10' ' ' VAL . 2.6 tm? -73.38 -51.15 18.39 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.475 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.1 ptm180 -64.78 -38.28 90.45 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.837 -179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.412 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.8 t -70.01 -26.41 64.05 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -73.53 -36.17 65.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.538 HD23 HD21 ' A' ' 68' ' ' LEU . 2.4 mp -63.43 -39.13 93.65 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 173.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 15' ' ' ARG . 70.2 t -59.19 -49.93 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.405 0.682 . . . . 0.0 109.31 172.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -52.31 -46.33 65.95 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 124.569 1.148 . . . . 0.0 110.814 176.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' CE ' ' HB2' ' B' ' 118' ' ' ASP . 55.0 mttm -64.15 -42.36 96.81 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.277 177.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 19' ' ' VAL . 89.4 mt -54.63 -46.06 73.83 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -57.38 -49.97 78.43 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.758 175.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -68.03 -24.15 65.07 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.554 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.37 -46.34 16.21 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.003 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.56 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.9 tt -70.89 -29.33 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.958 0.885 . . . . 0.0 110.003 -178.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -127.14 90.74 48.41 Favored Pre-proline 0 N--CA 1.401 -2.901 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.025 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.412 ' HG3' ' HB2' ' B' ' 137' ' ' LEU . 15.9 Cg_endo -55.64 127.31 25.63 Favored 'Trans proline' 0 N--CA 1.447 -1.244 0 C-N-CA 122.398 2.065 . . . . 0.0 108.22 170.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 p -70.46 120.59 79.61 Favored Pre-proline 0 C--N 1.283 -2.308 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -87.17 -26.5 0.82 Allowed 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.067 1.178 . . . . 0.0 109.046 167.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -154.13 140.61 12.9 Favored Pre-proline 0 CA--C 1.495 -1.149 0 C-N-CA 125.471 1.508 . . . . 0.0 107.225 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -67.42 -19.48 49.24 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.276 1.318 . . . . 0.0 110.586 171.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.61 -6.81 59.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -13.99 59.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 122.333 1.063 . . . . 0.0 108.43 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.0 4.49 16.82 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 114.172 -1.377 . . . . 0.0 110.102 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.41 22.92 3.73 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.16 0.505 . . . . 0.0 110.987 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.482 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 10.2 t70 -87.56 -176.99 5.78 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.482 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.3 -17.44 62.46 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 119.823 1.192 . . . . 0.0 110.418 -179.229 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 21.9 ttm180 -70.97 -20.31 62.45 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.404 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.68 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.8 tpp -66.94 -42.89 84.52 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.07 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.8 pt-20 -59.86 -29.53 68.36 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.062 -0.655 . . . . 0.0 109.869 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.42 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 6.3 t30 -73.61 -51.53 16.52 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 124.571 1.148 . . . . 0.0 110.346 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.22 -44.17 80.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.749 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.68 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -72.62 -33.33 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.893 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.071 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.57 -45.26 89.38 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.583 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.0 t80 -60.41 -50.49 73.37 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.696 174.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.88 -39.66 90.07 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 120.714 0.292 . . . . 0.0 110.951 -176.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 95.2 mttt -65.22 -45.24 85.5 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 123.373 0.669 . . . . 0.0 111.552 177.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.9 pttp -65.72 -39.25 90.98 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.152 0.501 . . . . 0.0 109.726 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 54' ' ' MET . 53.5 t -67.09 -52.39 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.807 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -55.59 -50.11 70.97 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 124.122 0.889 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.06 -40.7 97.42 Favored Glycine 0 CA--C 1.507 -0.461 0 O-C-N 123.607 0.567 . . . . 0.0 112.642 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.39 -54.26 48.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.031 0.443 . . . . 0.0 110.187 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.577 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.6 ptp -70.26 -30.51 67.56 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.28 -40.97 97.05 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.573 ' HA ' ' NZ ' ' A' ' 4' ' ' LYS . 17.0 mt-10 -78.74 -24.97 44.53 Favored 'General case' 0 C--N 1.313 -1.003 0 O-C-N 121.149 -0.969 . . . . 0.0 112.067 177.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.472 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 50.0 m -86.67 -18.8 30.37 Favored 'General case' 0 C--N 1.277 -2.561 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -175.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -94.25 160.14 14.82 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -98.59 -2.66 38.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.689 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.521 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 81.2 p -158.64 161.67 37.2 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.41 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -70.48 -29.74 66.36 Favored 'General case' 0 C--O 1.185 -2.292 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.915 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.77 -41.57 83.08 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 7.6 tp10 -62.97 -49.53 74.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 176.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -43.64 98.25 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.782 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.506 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -54.21 -48.88 70.55 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 172.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.0 -55.8 16.87 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.787 -172.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 54' ' ' MET . 2.1 pp -65.62 -30.16 70.84 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -177.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.538 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.92 -39.26 56.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 177.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.66 -32.94 73.14 Favored 'General case' 0 C--N 1.351 0.639 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.9 mm-40 -65.56 -47.08 77.05 Favored 'General case' 0 C--O 1.249 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 111.705 174.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -36.3 66.78 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.039 -1.064 . . . . 0.0 112.048 -177.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.8 tt -65.35 -37.8 80.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.785 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.5 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 12.5 t80 -54.25 -54.02 45.77 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 124.599 1.16 . . . . 0.0 111.907 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -65.41 -32.94 74.83 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.848 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.6 -41.02 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 51.5 mt-30 -64.27 -48.26 76.4 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.537 0.684 . . . . 0.0 110.622 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.84 -26.55 59.78 Favored 'General case' 0 N--CA 1.398 -3.057 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.6 tt0 -61.51 -48.63 80.17 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.737 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.4 pp -66.51 -38.2 86.69 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.926 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -64.11 -47.85 78.4 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -63.48 -41.06 98.58 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 118.268 0.485 . . . . 0.0 111.543 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.402 ' HD2' ' N ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -71.46 -34.38 70.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.024 -0.67 . . . . 0.0 111.434 -178.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.621 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -77.22 -39.25 49.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.837 -177.245 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -98.23 -57.42 2.21 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -170.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.5 p -150.97 95.19 2.16 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -170.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -160.27 -34.56 0.05 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 168.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.5 mp . . . . . 0 C--O 1.249 1.051 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.681 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.096 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m 57.76 82.3 0.13 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 123.673 0.789 . . . . 0.0 110.563 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 80.2 mtp 59.98 68.92 0.74 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.64 0.776 . . . . 0.0 108.974 -175.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.1 m -70.01 161.56 29.82 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.446 -176.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -80.48 90.83 5.68 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 56.1 p90 -72.02 -176.07 1.64 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.732 -175.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.74 -50.85 0.86 Allowed Glycine 0 N--CA 1.417 -2.581 0 N-CA-C 109.246 -1.542 . . . . 0.0 109.246 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 34.1 p-10 -75.93 -14.09 60.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 113.639 -1.28 . . . . 0.0 111.767 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -68.37 -42.15 79.59 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.907 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.648 ' HA ' ' OD2' ' B' ' 113' ' ' ASP . 7.6 t -71.33 -31.27 67.2 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.728 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.79 -35.53 81.38 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.256 175.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 29.7 mm-40 -64.55 -40.16 95.07 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . 0.648 ' OD2' ' HA ' ' B' ' 110' ' ' THR . 38.2 m-20 -54.17 -48.51 70.85 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.39 0.431 . . . . 0.0 110.417 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.78 -46.12 88.26 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.802 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -57.71 -63.45 1.24 Allowed 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.835 177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.506 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 14.9 t -60.17 -39.29 85.9 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.7 t -71.74 -47.54 53.1 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.074 -174.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB2' ' CE ' ' A' ' 21' ' ' LYS . 15.9 m-20 -71.73 -54.2 11.05 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.72 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 5.5 m -60.47 -44.53 95.8 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -171.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.03 -19.96 39.33 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -176.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.9 t -76.29 -40.79 50.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -64.45 -50.75 66.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.427 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 64.3 p 56.71 -90.98 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.966 1.707 . . . . 0.0 112.55 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.506 ' HA ' ' CB ' ' A' ' 13' ' ' ASP . 6.6 p-10 -142.56 20.1 2.03 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.71 0.767 . . . . 0.0 110.314 177.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -132.79 -123.63 2.45 Favored Glycine 0 N--CA 1.432 -1.587 0 N-CA-C 109.342 -1.503 . . . . 0.0 109.342 177.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 97.52 131.87 7.24 Favored Glycine 0 N--CA 1.434 -1.437 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.352 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -113.82 12.14 22.75 Favored Glycine 0 N--CA 1.438 -1.225 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 175.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.1 m -64.87 -46.41 81.91 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 122.824 0.449 . . . . 0.0 109.792 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 71.93 -111.82 3.79 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.503 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.96 149.95 21.82 Favored Glycine 0 N--CA 1.42 -2.367 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 178.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 169.51 108.65 0.21 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 34.5 t -174.45 145.84 1.0 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -143.23 176.3 22.8 Favored Glycine 0 N--CA 1.437 -1.283 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 162.22 -64.25 0.26 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.701 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 141.83 -170.37 24.88 Favored Glycine 0 N--CA 1.44 -1.038 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.682 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 36.5 m -93.74 90.71 6.68 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-O 121.723 0.773 . . . . 0.0 111.503 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.412 ' HB2' ' HG3' ' A' ' 28' ' ' PRO . 7.7 mp -99.32 -15.6 18.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.633 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' B' ' 139' ' ' CYS . 0.0 OUTLIER -70.12 -62.6 1.32 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.203 0.445 . . . . 0.0 112.203 -177.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . 0.42 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 45.7 m 23.57 -83.23 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 128.316 2.646 . . . . 0.0 116.146 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -39.88 85.26 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.847 1.259 . . . . 0.0 110.233 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.737 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 21.3 ttt -66.47 -23.68 66.31 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.987 -174.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.55 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 42.9 mt-10 -57.71 -26.74 62.19 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 26.0 m -66.88 -49.11 66.68 Favored 'General case' 0 C--O 1.26 1.614 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.975 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.9 pp -71.12 -28.06 31.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.834 0.826 . . . . 0.0 110.183 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.56 ' CG2' HD11 ' A' ' 26' ' ' ILE . 12.1 mm -67.79 -44.48 85.58 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.252 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.138 174.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.1 ttp180 -60.62 -39.1 86.97 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 22.9 t -61.24 -50.63 72.28 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.66 -53.16 61.24 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.454 1.101 . . . . 0.0 112.588 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.502 HD12 ' N ' ' B' ' 150' ' ' MET . 3.7 pp -72.71 -31.18 64.8 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -173.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.502 ' N ' HD12 ' B' ' 149' ' ' LEU . 49.5 tpp -75.91 -43.41 45.31 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.454 -174.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -151.4 131.9 13.84 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.288 0.566 . . . . 0.0 110.882 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.518 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 179.808 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.247 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 69.6 t 78.96 120.78 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 C-N-CA 124.395 1.078 . . . . 0.0 110.058 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.423 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 5.0 tpt180 -81.05 117.3 21.53 Favored 'General case' 0 N--CA 1.413 -2.292 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.598 -174.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -127.81 114.87 17.79 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.91 -29.98 8.77 Favored Glycine 0 N--CA 1.477 1.37 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.489 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 62.4 p-90 -63.98 -17.84 63.68 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -69.35 -13.47 62.39 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.876 -177.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -89.61 -2.98 58.48 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.485 0.659 . . . . 0.0 109.788 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -95.62 -13.17 24.56 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.528 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.71 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -104.77 110.77 31.79 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.722 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.8 m -73.3 149.61 42.55 Favored 'General case' 0 C--N 1.279 -2.459 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -38.48 72.08 Favored 'General case' 0 C--O 1.209 -1.049 0 O-C-N 123.556 0.535 . . . . 0.0 109.654 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -67.89 -29.02 68.02 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -75.64 -52.97 9.33 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.2 ptm180 -58.66 -41.79 86.92 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.178 176.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.5 t -69.21 -25.4 64.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.442 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 15.2 t60 -67.98 -38.95 83.31 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.432 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -67.8 -37.72 82.38 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.811 177.281 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.2 t -57.04 -47.87 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-O 121.548 0.69 . . . . 0.0 109.384 174.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 20.2 t-80 -53.93 -50.66 65.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.503 176.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HD3' HD23 ' B' ' 115' ' ' LEU . 54.8 mttm -64.6 -37.11 86.45 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 19' ' ' VAL . 81.6 mt -55.58 -43.92 76.4 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.342 0.401 . . . . 0.0 109.941 176.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' HB3' ' A' ' 43' ' ' LEU . 2.3 t -60.08 -53.61 46.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 O-C-N 123.684 0.615 . . . . 0.0 111.905 175.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -65.48 -27.53 68.56 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.817 0.341 . . . . 0.0 111.624 -176.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.33 -43.2 19.41 Favored 'General case' 0 N--CA 1.424 -1.765 0 CA-C-O 119.275 -0.393 . . . . 0.0 111.947 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.588 HD11 HG23 ' B' ' 145' ' ' ILE . 1.8 tt -70.22 -39.93 77.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.405 0 CA-C-O 121.606 0.717 . . . . 0.0 109.66 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.44 ' CD2' ' HD3' ' A' ' 39' ' ' ARG . 4.4 m-85 -125.66 102.29 29.28 Favored Pre-proline 0 N--CA 1.401 -2.887 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.759 -177.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 51.1 Cg_exo -48.86 140.89 22.59 Favored 'Trans proline' 0 N--CA 1.438 -1.766 0 C-N-CA 123.294 2.663 . . . . 0.0 111.347 175.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.45 109.92 63.49 Favored Pre-proline 0 N--CA 1.382 -3.847 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.481 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.07 -26.92 4.88 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 121.92 1.747 . . . . 0.0 110.622 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -156.42 143.23 13.46 Favored Pre-proline 0 N--CA 1.433 -1.322 0 N-CA-C 106.22 -1.77 . . . . 0.0 106.22 -176.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.91 -21.82 42.87 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.612 2.208 . . . . 0.0 113.761 176.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.52 -18.02 63.64 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.561 -0.712 . . . . 0.0 112.306 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.3 -14.76 63.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.652 0.739 . . . . 0.0 110.173 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.485 ' O ' ' HG2' ' A' ' 40' ' ' MET . 13.2 mt -91.32 1.78 56.86 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.569 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -133.16 14.91 4.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 122.076 0.941 . . . . 0.0 109.677 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 21.3 t70 -79.38 174.29 11.72 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.302 179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -25.89 63.01 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 178.543 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.44 ' HD3' ' CD2' ' A' ' 27' ' ' PHE . 23.9 ttm180 -61.03 -27.87 68.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.624 175.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.527 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 11.1 tpp -62.75 -42.49 99.7 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.773 -179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.7 pt-20 -60.54 -33.31 72.49 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 119.589 -0.844 . . . . 0.0 109.689 -176.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -71.97 -45.54 60.63 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.454 1.101 . . . . 0.0 110.479 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.485 ' HB3' HG22 ' A' ' 23' ' ' VAL . 95.5 mt -67.31 -45.32 76.81 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.327 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.513 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -72.83 -32.19 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 C-N-CA 120.534 -0.467 . . . . 0.0 110.239 -179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.89 -43.67 98.37 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.2 t80 -61.47 -51.45 68.61 Favored 'General case' 0 C--O 1.208 -1.085 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.975 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.24 87.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.629 0.252 . . . . 0.0 111.334 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -64.8 -42.64 94.88 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 14.4 pttp -70.5 -35.59 73.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.272 0.558 . . . . 0.0 110.208 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 46' ' ' TYR . 54.6 t -65.32 -49.68 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.162 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -55.43 -51.9 65.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.271 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.34 -38.85 91.66 Favored Glycine 0 C--N 1.333 0.393 0 O-C-N 123.642 0.589 . . . . 0.0 112.975 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -62.14 -54.12 45.68 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.254 0.55 . . . . 0.0 111.054 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 1.2 ptp -69.49 -27.82 65.53 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -62.47 -54.14 44.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.92 -17.81 60.5 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.184 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.0 t -79.72 -19.64 48.36 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 120.741 0.305 . . . . 0.0 110.96 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.48 165.25 12.09 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -175.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.43 6.12 37.46 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.284 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.489 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 7.2 t -173.59 162.66 4.21 Favored 'General case' 0 CA--C 1.479 -1.782 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.71 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.95 -30.37 71.35 Favored 'General case' 0 C--O 1.168 -3.197 0 O-C-N 123.804 0.69 . . . . 0.0 110.77 178.18 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -56.12 -47.39 78.21 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.891 0.853 . . . . 0.0 109.543 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -71.6 -43.8 65.58 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.494 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.402 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.62 -40.12 94.93 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.646 ' CE1' HD13 ' B' ' 115' ' ' LEU . 5.1 t80 -60.6 -47.05 87.93 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.207 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.65 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 40.5 t-80 -63.35 -53.76 47.5 Favored 'General case' 0 C--O 1.205 -1.253 0 O-C-N 123.716 0.635 . . . . 0.0 111.524 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.5 pp -67.87 -30.47 69.84 Favored 'General case' 0 C--O 1.256 1.43 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.167 -174.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.432 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.23 -44.05 63.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 174.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -52.95 -33.0 48.91 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.394 0.678 . . . . 0.0 111.717 173.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 31.3 mt-10 -73.38 -44.63 58.17 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.549 0.214 . . . . 0.0 110.845 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.12 -37.74 78.49 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 118.687 -1.205 . . . . 0.0 110.509 -179.432 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.633 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.6 tt -67.67 -36.77 77.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -52.8 -54.29 36.19 Favored 'General case' 0 C--O 1.258 1.527 0 C-N-CA 124.505 1.122 . . . . 0.0 110.379 174.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.36 -31.82 70.49 Favored 'General case' 0 C--O 1.204 -1.334 0 O-C-N 123.8 0.688 . . . . 0.0 110.771 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.539 ' HA ' ' HE1' ' B' ' 141' ' ' MET . 1.3 mp -63.15 -46.93 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 O-C-N 123.389 0.431 . . . . 0.0 109.955 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 52.5 mt-30 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.699 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.578 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.4 OUTLIER -74.07 -28.22 61.28 Favored 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.421 -176.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -62.49 -52.79 62.1 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.656 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -62.03 -44.54 96.49 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.927 -179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.3 OUTLIER -62.63 -53.63 51.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.698 -178.099 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.3 pt-20 -76.35 -34.77 58.95 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -28.71 60.89 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.029 -178.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -70.99 -44.27 66.31 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -70.54 -45.69 65.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.449 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 31.6 t 79.5 85.14 0.06 Allowed 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 125.324 1.45 . . . . 0.0 111.103 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' A' ' 81' ' ' GLU . 2.0 ptm180 -110.49 1.23 18.11 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.084 177.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--N 1.309 -1.159 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.976 -177.262 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.667 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 24.6 m 67.33 -74.71 0.07 Allowed 'General case' 0 C--O 1.245 0.839 0 C-N-CA 125.063 1.345 . . . . 0.0 111.238 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 28.0 ttt -146.72 78.96 1.52 Allowed 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 121.725 0.774 . . . . 0.0 110.745 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 50.8 m -129.39 -1.55 5.0 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-N 114.42 -1.264 . . . . 0.0 107.961 170.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 30.3 m80 66.14 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.986 1.714 . . . . 0.0 109.93 -178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.421 ' HB2' ' OE1' ' B' ' 109' ' ' GLN . 72.8 m-85 -119.61 -58.86 1.87 Allowed 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 172.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.2 -44.12 3.29 Favored Glycine 0 CA--C 1.495 -1.173 0 CA-C-N 114.539 -1.21 . . . . 0.0 113.803 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.558 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 32.8 p-10 -77.05 -11.1 59.76 Favored 'General case' 0 C--N 1.278 -2.542 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -170.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.421 ' OE1' ' HB2' ' B' ' 106' ' ' TYR . 5.1 pm0 -62.04 -35.02 77.34 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 123.461 0.476 . . . . 0.0 110.995 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 18.1 m -65.46 -40.97 93.85 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-O 121.244 0.545 . . . . 0.0 109.949 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.54 -40.45 85.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.866 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.558 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 25.0 mt-30 -64.52 -39.32 93.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.575 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.92 -50.96 68.79 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.647 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -42.23 90.94 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 123.166 0.291 . . . . 0.0 111.386 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.646 HD13 ' CE1' ' A' ' 65' ' ' TYR . 16.7 mt -51.44 -63.04 1.26 Allowed 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.643 0.59 . . . . 0.0 110.58 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 12.9 m -65.96 -28.48 68.93 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.495 -1.229 . . . . 0.0 112.298 -172.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' B' ' 121' ' ' SER . 51.0 m -68.3 -40.66 81.66 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 120.631 -0.428 . . . . 0.0 109.957 176.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -76.15 -47.85 22.76 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.659 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' B' ' 123' ' ' SER . 60.7 p -73.73 -56.58 4.81 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -173.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 77.0 mt -83.8 -54.54 4.82 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.44 ' HB3' ' O ' ' B' ' 117' ' ' SER . 26.7 t -63.34 -43.11 98.68 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -174.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 64.5 m80 -101.66 -45.69 5.18 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.077 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' B' ' 119' ' ' SER . 67.9 m 74.99 8.6 4.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.611 1.165 . . . . 0.0 113.244 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -122.12 156.43 33.63 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -145.27 154.38 25.88 Favored Glycine 0 N--CA 1.429 -1.792 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -157.58 171.5 34.77 Favored Glycine 0 N--CA 1.423 -2.172 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . 0.483 ' HA3' ' CD1' ' A' ' 35' ' ' LEU . . . -94.21 111.54 4.18 Favored Glycine 0 N--CA 1.428 -1.852 0 C-N-CA 120.459 -0.876 . . . . 0.0 112.524 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.7 m -88.7 142.45 27.67 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -86.99 116.33 4.44 Favored Glycine 0 N--CA 1.436 -1.364 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -92.27 -166.5 39.36 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.862 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -119.12 32.04 5.25 Favored Glycine 0 C--N 1.309 -0.971 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 5.2 p -89.02 -69.28 0.72 Allowed 'General case' 0 N--CA 1.422 -1.868 0 C-N-CA 123.39 0.676 . . . . 0.0 111.146 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 116.16 160.99 12.48 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -107.84 134.06 12.0 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 110.489 -1.045 . . . . 0.0 110.489 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.15 32.96 7.52 Favored Glycine 0 N--CA 1.433 -1.549 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.098 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.2 p -149.95 -76.36 0.15 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 5.9 mp -65.4 -49.8 67.91 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 121.251 0.548 . . . . 0.0 111.12 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -71.42 -40.97 70.12 Favored 'General case' 0 C--O 1.191 -1.985 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.184 178.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 48.0 t -56.31 -39.95 73.58 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.485 0.714 . . . . 0.0 110.915 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -57.08 14.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.982 0.896 . . . . 0.0 111.103 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.656 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.8 ttt -77.02 -14.6 59.81 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.436 -173.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.532 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 13.4 tm-20 -56.55 -27.01 56.61 Favored 'General case' 0 C--O 1.2 -1.546 0 C-N-CA 124.096 0.958 . . . . 0.0 112.422 -175.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 21.7 t -62.27 -49.95 73.65 Favored 'General case' 0 CA--C 1.568 1.646 0 CA-C-N 117.97 0.35 . . . . 0.0 110.755 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.44 HD11 ' CG ' ' B' ' 141' ' ' MET 0.261 2.7 pp -70.29 -24.88 26.3 Favored 'Isoleucine or valine' 0 C--O 1.252 1.201 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.905 176.364 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.588 HG23 HD11 ' A' ' 26' ' ' ILE . 16.9 mm -63.13 -43.16 98.74 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.888 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.398 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 78.0 mtp180 -56.84 -45.1 82.59 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.304 0.641 . . . . 0.0 110.625 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 6.1 p -60.11 -36.64 77.91 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 119.542 -0.863 . . . . 0.0 113.255 176.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -76.11 -44.95 36.16 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.231 -0.988 . . . . 0.0 112.295 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.445 HD12 ' N ' ' B' ' 150' ' ' MET 0.262 3.1 pp -70.24 -33.55 71.78 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.211 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.445 ' N ' HD12 ' B' ' 149' ' ' LEU . 50.5 ttm -70.53 -40.73 73.27 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.242 0.544 . . . . 0.0 111.039 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -92.61 117.67 30.22 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.447 -177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.476 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.115 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.759 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.2 m -127.57 148.46 32.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.467 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -116.06 93.09 4.1 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-O 122.287 1.041 . . . . 0.0 110.108 179.313 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 10.4 ptpt -92.04 120.48 32.72 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.215 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.12 -18.92 36.44 Favored Glycine 0 N--CA 1.464 0.506 0 N-CA-C 116.156 1.223 . . . . 0.0 116.156 -168.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.4 p-90 -76.01 -2.14 29.15 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 117.48 0.64 . . . . 0.0 112.087 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -62.53 -21.33 65.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.449 0.642 . . . . 0.0 110.793 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -86.2 -10.55 54.49 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.809 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -102.85 5.21 38.47 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.867 0.841 . . . . 0.0 110.09 -177.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 6.3 p -129.31 110.79 21.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.5 m -83.22 151.04 25.84 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.456 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.8 56.98 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.934 0.894 . . . . 0.0 111.33 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -69.73 -30.05 67.56 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.409 HD12 HG23 ' A' ' 10' ' ' VAL . 2.9 tm? -74.76 -47.69 29.71 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 -177.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.538 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -64.93 -41.25 95.7 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.621 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 t -69.6 -25.35 63.92 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.596 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 15.6 t60 -75.31 -36.86 61.04 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.888 177.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 HD21 ' A' ' 68' ' ' LEU . 1.4 mp -63.29 -37.63 87.99 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 173.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 15' ' ' ARG . 99.5 t -60.21 -45.78 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 19.4 t-80 -55.77 -47.04 77.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.881 177.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -66.49 -39.21 88.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.78 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 26' ' ' ILE . 28.8 mt -53.47 -48.35 68.94 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 123.547 0.529 . . . . 0.0 109.799 173.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.431 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.8 t -54.67 -48.64 71.72 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 O-C-N 124.237 0.96 . . . . 0.0 111.612 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -69.37 -24.19 63.85 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.2 -44.55 16.24 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.503 175.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.679 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.09 -29.61 37.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.958 0.885 . . . . 0.0 109.517 -177.743 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -123.46 84.62 52.65 Favored Pre-proline 0 N--CA 1.403 -2.822 0 CA-C-N 114.317 -1.31 . . . . 0.0 108.899 177.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.424 ' CG ' ' HB2' ' B' ' 137' ' ' LEU . 10.4 Cg_endo -53.87 115.95 2.68 Favored 'Trans proline' 0 N--CA 1.443 -1.468 0 C-N-CA 122.396 2.064 . . . . 0.0 109.072 171.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.47 118.05 67.92 Favored Pre-proline 0 N--CA 1.394 -3.225 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -168.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -78.92 -25.31 6.28 Favored 'Trans proline' 0 N--CA 1.442 -1.506 0 C-N-CA 121.698 1.599 . . . . 0.0 109.537 172.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -167.42 145.43 4.0 Favored Pre-proline 0 CA--C 1.506 -0.731 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.23 -22.95 74.97 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.851 2.367 . . . . 0.0 114.167 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.19 -5.91 53.24 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.029 -1.044 . . . . 0.0 111.778 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.42 -8.36 59.05 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 40' ' ' MET . 28.6 mt -89.55 7.09 38.07 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.55 -178.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.68 22.12 4.27 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.197 0.998 . . . . 0.0 108.944 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.597 ' O ' ' HB3' ' A' ' 40' ' ' MET . 19.3 t70 -95.61 172.68 7.91 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.618 -1.174 . . . . 0.0 111.058 -176.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.1 OUTLIER -68.12 -22.84 64.86 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 122.794 0.437 . . . . 0.0 111.476 -178.438 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -79.05 -17.16 55.73 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.713 0.768 . . . . 0.0 109.416 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.597 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 8.3 tpp -62.98 -43.14 99.6 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.124 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -56.04 -38.84 71.12 Favored 'General case' 0 C--O 1.193 -1.873 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.082 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.407 HD21 HD22 ' B' ' 149' ' ' LEU . 2.8 t30 -68.09 -45.0 74.99 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.782 0.833 . . . . 0.0 111.546 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 37.4 mt -67.89 -43.44 79.31 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.184 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.9 p -73.25 -33.22 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.165 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.263 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.07 -44.05 97.51 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.517 0.675 . . . . 0.0 109.392 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.679 ' CE1' HG13 ' A' ' 26' ' ' ILE . 3.9 t80 -61.0 -47.19 87.59 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.263 174.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.78 -41.13 97.32 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.501 -177.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -63.03 -46.3 88.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.898 176.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 19.7 pttp -64.06 -39.13 93.4 Favored 'General case' 0 C--O 1.246 0.889 0 CA-C-O 121.021 0.439 . . . . 0.0 110.528 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.58 -50.39 66.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.134 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -57.01 -47.79 80.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.719 0.807 . . . . 0.0 109.896 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -42.83 93.66 Favored Glycine 0 N--CA 1.446 -0.682 0 O-C-N 123.666 0.603 . . . . 0.0 112.632 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.35 -54.11 50.53 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.368 0.604 . . . . 0.0 110.564 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.521 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 ptp -67.16 -33.14 74.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.61 -50.96 71.86 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.01 -18.01 60.91 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.842 -178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -75.58 -54.52 6.87 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 122.374 0.269 . . . . 0.0 111.446 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.53 168.32 7.58 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.19 9.29 15.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.027 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.453 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 73.2 m -161.15 153.81 20.66 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 175.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.539 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.39 -39.58 74.46 Favored 'General case' 0 C--O 1.182 -2.472 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.461 -177.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.453 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 2.8 p-10 -62.78 -32.47 73.64 Favored 'General case' 0 C--N 1.294 -1.812 0 C-N-CA 124.545 1.138 . . . . 0.0 109.479 176.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -71.96 -46.72 56.4 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.156 174.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -41.45 99.17 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.58 -49.06 77.63 Favored 'General case' 0 C--O 1.196 -1.731 0 C-N-CA 125.235 1.414 . . . . 0.0 109.381 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -66.12 -48.39 71.0 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 122.535 0.334 . . . . 0.0 111.669 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.444 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.8 pp -69.35 -29.96 67.88 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.642 -177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.548 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -75.93 -37.41 58.75 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.578 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.04 -35.93 80.09 Favored 'General case' 0 C--O 1.204 -1.317 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 7.2 mm-40 -59.89 -52.04 67.13 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.803 0.841 . . . . 0.0 110.263 172.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -59.73 -47.74 84.46 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.398 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.618 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.3 tt -68.16 -37.23 77.8 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.157 -177.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 13.0 t80 -56.88 -54.11 50.28 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 125.269 1.428 . . . . 0.0 111.395 176.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.4 ptpt -66.23 -32.28 73.61 Favored 'General case' 0 C--O 1.209 -1.04 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.411 -177.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.46 -39.54 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.684 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.0 mt-30 -66.2 -46.45 77.25 Favored 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.922 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.642 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.1 ptpt -75.2 -27.99 59.82 Favored 'General case' 0 N--CA 1.401 -2.92 0 C-N-CA 119.41 -0.916 . . . . 0.0 112.369 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 10.5 tp10 -57.54 -52.89 63.57 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.525 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.6 pp -66.59 -41.55 88.33 Favored 'General case' 0 C--O 1.25 1.101 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.77 -178.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' N ' HD12 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -60.77 -53.8 52.92 Favored 'General case' 0 N--CA 1.416 -2.165 0 C-N-CA 123.251 0.62 . . . . 0.0 110.433 -177.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -73.35 -32.31 64.46 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -175.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.518 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -65.6 -34.11 77.47 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.245 179.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.421 ' HG2' ' CD2' ' B' ' 137' ' ' LEU . 19.7 tpt180 -76.93 -35.92 56.97 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 121.619 0.723 . . . . 0.0 109.363 177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -70.16 -58.43 3.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.066 -172.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.0 p -128.09 -64.42 0.96 Allowed 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -168.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.518 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 7.3 ptm180 -52.83 -26.53 14.83 Favored 'General case' 0 C--N 1.274 -2.691 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.175 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 82' ' ' LYS . 7.2 mp . . . . . 0 C--O 1.257 1.499 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 173.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' B' ' 104' ' ' SER . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 19.3 t -94.09 -19.51 20.76 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.061 0.458 . . . . 0.0 110.225 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.0 ttt -118.98 -48.92 2.43 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.498 ' O ' ' HA2' ' B' ' 101' ' ' GLY . 23.2 t -94.78 92.12 6.81 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 171.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -74.35 172.2 12.32 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.975 -1.012 . . . . 0.0 113.352 -169.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -103.76 49.23 0.83 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 105.838 -1.912 . . . . 0.0 105.838 172.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.88 83.12 0.16 Allowed Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.124 -175.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.515 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 28.4 p30 -101.3 14.44 31.96 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 123.851 0.86 . . . . 0.0 111.355 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -65.15 -36.75 85.22 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -170.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 33.9 m -61.63 -45.07 95.63 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 121.476 0.655 . . . . 0.0 109.417 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.57 -45.94 56.77 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.845 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 14.0 mm100 -60.48 -42.94 97.31 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.24 -47.6 79.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.426 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.98 -44.16 82.4 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.75 0.656 . . . . 0.0 109.624 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.48 -60.62 3.5 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.867 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 17.5 m -57.05 -48.79 77.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.86 0.362 . . . . 0.0 111.837 -173.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 m -69.94 -52.61 23.03 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.047 -174.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.18 -40.88 59.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.566 -174.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.596 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 33.1 t -64.27 -53.95 41.02 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 84.3 mt -67.68 -26.57 66.26 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 30.8 m -76.39 -47.78 22.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.059 0.457 . . . . 0.0 110.748 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -73.37 -29.58 62.73 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.21 0.819 . . . . 0.0 113.21 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 68.2 p -79.41 -7.28 58.27 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.475 0.655 . . . . 0.0 110.474 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -86.61 -45.52 10.95 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.533 176.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -82.6 -79.41 1.0 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.927 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 169.83 45.24 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.963 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.816 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 52.37 41.14 54.71 Favored Glycine 0 N--CA 1.465 0.573 0 O-C-N 123.907 0.416 . . . . 0.0 114.088 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 9.2 m -106.17 117.37 33.87 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 101.59 3.18 53.11 Favored Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -76.24 118.54 5.35 Favored Glycine 0 N--CA 1.439 -1.161 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -164.99 150.61 18.77 Favored Glycine 0 N--CA 1.424 -2.159 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.777 -177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 20.4 t -170.68 162.03 7.68 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 104.913 -2.254 . . . . 0.0 104.913 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -127.28 -171.38 13.04 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.076 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -161.1 -58.38 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 127.64 -160.87 21.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.541 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.9 m -84.51 35.63 0.56 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.708 0.765 . . . . 0.0 109.973 -178.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.424 ' HB2' ' CG ' ' A' ' 28' ' ' PRO . 45.1 mt -85.45 -24.27 27.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.715 -175.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -42.94 98.36 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -175.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 2.8 p -69.13 -2.26 9.81 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -111.12 -41.76 4.11 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 173.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.525 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 14.5 tpt -57.95 -37.94 75.06 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.448 1.099 . . . . 0.0 109.822 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.528 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 35.0 mt-10 -48.98 -26.86 2.76 Favored 'General case' 0 C--O 1.187 -2.234 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 177.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.4 m -62.04 -60.33 3.77 Favored 'General case' 0 C--O 1.27 2.134 0 CA-C-N 119.391 0.996 . . . . 0.0 111.249 178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.522 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.7 pp -72.53 -25.53 22.95 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 CA-C-O 122.492 1.139 . . . . 0.0 110.532 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.595 ' CG2' HD11 ' A' ' 26' ' ' ILE . 5.9 mm -70.48 -37.58 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.093 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.431 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.489 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 32.3 ttm180 -64.32 -36.55 84.48 Favored 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 m -57.83 -49.02 78.08 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.186 173.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -68.62 -41.63 79.21 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.489 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -77.27 -20.41 55.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -175.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 27.7 ttt -75.33 -31.62 60.64 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -89.7 171.16 9.85 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.62 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.665 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.624 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 86.8 t -102.79 133.56 46.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.463 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 10.1 tpt180 -84.99 108.99 17.86 Favored 'General case' 0 N--CA 1.414 -2.235 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.102 -172.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -121.67 120.17 33.94 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.69 -8.52 72.45 Favored Glycine 0 C--N 1.296 -1.692 0 C-N-CA 120.054 -1.069 . . . . 0.0 114.552 -173.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -75.74 -18.56 59.52 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.389 19.6 p80 -72.32 -0.52 12.53 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -174.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -90.56 -6.32 54.85 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.152 0.501 . . . . 0.0 109.878 173.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -106.72 11.99 29.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.206 0.527 . . . . 0.0 112.136 -176.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.474 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.7 p -129.05 109.9 19.67 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 CA-C-O 122.119 0.961 . . . . 0.0 109.51 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.0 m -73.87 150.74 40.75 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.842 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -38.36 84.64 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -61.29 -37.25 82.5 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.592 176.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.435 HD12 HG23 ' A' ' 10' ' ' VAL . 3.4 tm? -73.35 -45.51 54.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -173.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.546 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.4 ptm180 -70.41 -43.35 70.16 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.199 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.4 t -65.77 -28.07 68.75 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -64.97 -48.22 74.78 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.466 HD11 ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -60.56 -38.75 85.57 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.823 177.415 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.0 t -57.46 -47.34 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.121 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.552 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 13.2 t-80 -62.98 -38.65 92.0 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.798 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.9 -35.6 77.04 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 119.11 -1.036 . . . . 0.0 111.538 175.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.58 -42.29 78.42 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.5 t -58.59 -50.25 79.67 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.713 173.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.552 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 37.4 mt-30 -62.52 -30.49 71.33 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.856 0.36 . . . . 0.0 111.64 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.35 -43.42 21.17 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.494 HG13 HG12 ' B' ' 145' ' ' ILE . 3.1 tt -70.68 -32.96 51.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.953 0.882 . . . . 0.0 109.62 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.556 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 79.1 t80 -125.37 84.96 59.13 Favored Pre-proline 0 N--CA 1.407 -2.594 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.531 -176.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -59.66 85.38 0.07 OUTLIER 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 123.073 2.516 . . . . 0.0 108.804 168.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -63.75 140.61 97.85 Favored Pre-proline 0 N--CA 1.424 -1.744 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -170.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -81.4 -21.19 6.52 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.945 2.43 . . . . 0.0 111.532 174.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -153.68 135.16 8.75 Favored Pre-proline 0 CA--C 1.505 -0.759 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -53.47 -24.25 27.68 Favored 'Trans proline' 0 CA--C 1.558 1.713 0 C-N-CA 122.726 2.284 . . . . 0.0 113.812 175.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.15 -14.7 59.36 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.826 -0.546 . . . . 0.0 111.68 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.66 -10.95 59.87 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.934 0.873 . . . . 0.0 109.494 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.2 mt -85.32 3.01 41.66 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.371 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.76 15.18 4.36 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.762 0.792 . . . . 0.0 110.052 177.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 36.3 t70 -74.93 175.63 7.91 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.947 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.06 -21.66 62.22 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.477 0.656 . . . . 0.0 110.417 178.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.428 ' NH1' ' HE1' ' A' ' 27' ' ' PHE . 60.0 ttt180 -75.52 -16.0 60.33 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.567 0.699 . . . . 0.0 109.2 176.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.662 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.58 -40.9 93.26 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.456 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -58.48 -32.13 68.48 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.233 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -72.02 -49.67 34.93 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 124.27 1.028 . . . . 0.0 110.774 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.71 -43.32 84.65 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.867 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.662 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.6 p -73.36 -28.05 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.25 -49.93 75.09 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.428 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -57.83 -46.16 85.13 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.998 175.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.31 90.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 120.512 0.196 . . . . 0.0 111.456 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -63.17 -44.62 94.93 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.205 0.602 . . . . 0.0 112.182 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 15.1 pttp -68.22 -36.95 80.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.188 0.518 . . . . 0.0 110.111 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.2 t -66.99 -47.72 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.612 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -55.52 -49.79 71.7 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.655 0.782 . . . . 0.0 108.999 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.44 84.84 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.922 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.12 -54.69 22.39 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.617 -0.343 . . . . 0.0 110.728 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.462 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.8 OUTLIER -66.78 -27.53 67.66 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.449 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.33 -53.75 47.73 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -67.7 -34.31 76.62 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.35 0.595 . . . . 0.0 111.574 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 33.8 m -68.53 -24.51 64.66 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.31 161.25 14.76 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -107.5 5.4 27.11 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.65 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.8 p -163.98 157.53 18.59 Favored 'General case' 0 CA--C 1.477 -1.833 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 175.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.27 -28.55 63.19 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 118.822 -1.151 . . . . 0.0 110.126 -178.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -67.06 -40.11 87.03 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -64.17 -45.27 89.15 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.463 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -43.6 92.95 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.889 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.693 ' CE1' HD13 ' B' ' 115' ' ' LEU . 10.9 t80 -60.68 -47.43 86.29 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.505 1.122 . . . . 0.0 109.944 178.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -63.38 -50.58 69.33 Favored 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.3 pp -70.55 -30.23 66.9 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.653 -175.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.408 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.8 OUTLIER -70.51 -43.28 69.98 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.562 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -55.34 -41.23 72.21 Favored 'General case' 0 C--O 1.202 -1.418 0 O-C-N 123.795 0.684 . . . . 0.0 110.795 173.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -56.96 -49.66 75.0 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 123.399 0.679 . . . . 0.0 111.718 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -36.3 68.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.573 -177.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.562 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.7 tt -69.61 -35.69 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.4 t80 -56.65 -52.5 64.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 124.975 1.31 . . . . 0.0 110.593 175.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.6 ptpt -67.02 -32.4 73.6 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.375 -177.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.37 -43.01 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 O-C-N 123.244 0.34 . . . . 0.0 110.743 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.9 mt-30 -63.06 -52.71 61.71 Favored 'General case' 0 CA--C 1.491 -1.311 0 O-C-N 123.757 0.661 . . . . 0.0 110.679 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.61 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.8 ptpt -72.39 -27.93 62.68 Favored 'General case' 0 N--CA 1.409 -2.493 0 C-N-CA 119.184 -1.006 . . . . 0.0 112.908 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 40.4 tp10 -57.48 -52.89 63.56 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.1 -43.18 75.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.591 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 74.2 mm-40 -61.63 -52.93 62.32 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.9 pt-20 -71.46 -32.67 68.58 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.646 -0.822 . . . . 0.0 111.411 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -71.54 -27.58 63.28 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.198 0.523 . . . . 0.0 110.458 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.4 tpt180 -73.11 -49.89 25.86 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.004 172.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 18.0 ptp180 -89.29 -56.18 3.37 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -171.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.9 p -134.02 -6.99 2.71 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 118.721 2.86 . . . . 0.0 118.721 -167.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.538 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 2.4 ptp180 -87.55 -16.66 34.0 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 116.958 -1.897 . . . . 0.0 109.856 177.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.509 HD22 ' HG3' ' A' ' 86' ' ' ARG . 4.0 mm? . . . . . 0 C--O 1.258 1.549 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.346 0 N-CA-C 111.665 -0.574 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 32.1 t -85.61 81.31 8.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 59.0 ttp -85.78 -52.07 6.0 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.691 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 25.2 t -74.22 115.02 13.24 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 177.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -91.23 164.89 13.73 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 120.967 0.413 . . . . 0.0 111.036 -173.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -83.91 26.0 0.76 Allowed 'General case' 0 C--O 1.24 0.564 0 C-N-CA 124.278 1.031 . . . . 0.0 109.506 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . 0.401 ' HA2' HE21 ' B' ' 109' ' ' GLN . . . -81.11 57.21 4.86 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.833 -174.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.513 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 38.2 p30 -83.77 0.51 47.03 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.401 HE21 ' HA2' ' B' ' 107' ' ' GLY . 5.7 pt20 -50.42 -43.19 54.8 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 124.797 1.239 . . . . 0.0 113.408 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 8.8 t -67.6 -35.83 79.7 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.584 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.41 -45.65 53.31 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.688 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 13.2 mm100 -64.22 -40.81 96.81 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.096 -178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.36 -40.85 85.8 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.634 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 67.8 tp -56.28 -53.69 54.2 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.693 HD13 ' CE1' ' A' ' 65' ' ' TYR . 26.4 mt -51.59 -65.24 0.59 Allowed 'General case' 0 C--O 1.205 -1.261 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.274 176.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.7 m -59.37 -31.8 69.55 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.96 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 56.7 m -69.1 -47.89 63.99 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.124 176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -76.5 -34.41 58.61 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.868 -176.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 66.7 p -73.89 -54.17 8.54 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.1 mt -81.79 -13.07 58.2 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' B' ' 124' ' ' ASP . 73.9 m -69.3 -11.52 60.88 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.846 0.355 . . . . 0.0 111.9 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -61.13 -31.89 71.59 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 173.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.7 m -95.16 -61.74 1.43 Allowed 'General case' 0 N--CA 1.422 -1.873 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.613 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.491 ' O ' ' HA ' ' B' ' 121' ' ' SER . 3.6 p30 -150.48 143.7 24.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 131.98 174.2 13.56 Favored Glycine 0 C--N 1.307 -1.04 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -122.06 19.85 8.18 Favored Glycine 0 C--N 1.31 -0.873 0 C-N-CA 121.016 -0.611 . . . . 0.0 111.973 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -70.02 120.16 9.4 Favored Glycine 0 N--CA 1.438 -1.18 0 N-CA-C 112.015 -0.434 . . . . 0.0 112.015 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.5 t -134.26 5.12 3.5 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.052 0.454 . . . . 0.0 110.021 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -63.88 149.42 50.59 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.186 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -144.11 -81.73 0.05 OUTLIER Glycine 0 N--CA 1.433 -1.559 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.774 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 166.24 -176.91 41.43 Favored Glycine 0 N--CA 1.438 -1.171 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.5 t -96.7 -22.59 16.9 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.9 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 88.51 -118.98 5.25 Favored Glycine 0 N--CA 1.426 -1.974 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -173.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 164.54 -70.14 0.2 Allowed Glycine 0 N--CA 1.438 -1.193 0 C-N-CA 119.079 -1.534 . . . . 0.0 113.713 175.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 127.99 -137.95 10.1 Favored Glycine 0 N--CA 1.428 -1.848 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 -175.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.549 ' HA ' ' OE2' ' B' ' 138' ' ' GLU . 31.3 m -75.97 57.01 1.03 Allowed 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.1 mp -104.6 -33.3 8.57 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.556 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -66.04 -31.16 71.89 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.147 -1.388 . . . . 0.0 112.122 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 63.9 m -52.67 -33.54 47.73 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.417 0.687 . . . . 0.0 112.126 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -89.93 -38.09 13.92 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.972 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.512 ' SD ' HD11 ' B' ' 144' ' ' ILE . 9.7 tpt -60.71 -22.59 64.12 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.935 1.294 . . . . 0.0 109.587 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' B' ' 138' ' ' GLU . 51.3 mt-10 -54.78 -25.82 30.57 Favored 'General case' 0 C--O 1.194 -1.823 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 29.5 p -63.57 -59.82 4.13 Favored 'General case' 0 C--O 1.265 1.914 0 CA-C-N 119.54 1.064 . . . . 0.0 110.859 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' B' ' 141' ' ' MET . 9.0 pt -61.92 -35.41 67.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.736 0.779 . . . . 0.0 109.911 176.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.494 HG12 HG13 ' A' ' 26' ' ' ILE . 1.4 mp -67.91 -34.29 66.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.564 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.069 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 146' ' ' ARG . 21.6 ttt180 -65.18 -47.53 76.64 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 8.8 p -63.53 -33.91 76.64 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.987 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -80.68 -35.64 33.39 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.5 pp -74.49 -23.59 58.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.023 0.374 . . . . 0.0 110.79 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 59.7 ttp -57.33 -38.35 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 123.976 0.797 . . . . 0.0 109.605 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.7 t70 61.75 73.93 0.46 Allowed 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.795 1.238 . . . . 0.0 111.313 174.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.554 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.109 -178.797 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.553 0 N-CA-C 111.618 -0.593 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.5 m -117.03 129.27 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.724 0 CA-C-O 121.305 0.574 . . . . 0.0 110.221 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.488 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -78.41 134.87 37.34 Favored 'General case' 0 C--N 1.289 -2.042 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 175.086 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.545 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.5 ptpt -127.5 94.26 3.93 Favored 'General case' 0 C--N 1.263 -3.175 0 CA-C-O 122.117 0.961 . . . . 0.0 111.196 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.64 0.13 10.83 Favored Glycine 0 CA--C 1.505 -0.536 0 CA-C-N 113.319 -1.764 . . . . 0.0 115.052 -173.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.545 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 68.1 p-90 -73.27 -9.13 58.38 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 117.392 0.596 . . . . 0.0 111.309 176.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -57.62 -21.94 42.46 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-O 121.475 0.655 . . . . 0.0 112.099 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.8 -19.51 58.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.557 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -94.57 4.07 54.31 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.716 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -130.64 109.48 17.05 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 178.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 m -74.86 154.36 38.27 Favored 'General case' 0 N--CA 1.413 -2.279 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -38.37 56.91 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.718 0.636 . . . . 0.0 110.261 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.684 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 13.9 t70 -60.41 -44.04 96.11 Favored 'General case' 0 C--O 1.179 -2.64 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.684 177.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.561 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.1 tm? -67.68 -51.58 47.98 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -171.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.561 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -60.38 -45.73 92.49 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.071 177.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 32.2 t -68.02 -22.25 64.98 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.953 0.882 . . . . 0.0 109.584 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.711 ' NE2' ' HA ' ' B' ' 119' ' ' SER . 2.1 t60 -71.61 -43.03 66.93 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.836 -1.074 . . . . 0.0 108.434 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -68.56 -33.6 74.37 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.735 176.013 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 15' ' ' ARG . 92.9 t -56.37 -48.14 80.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 O-C-N 123.773 0.671 . . . . 0.0 109.656 176.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.469 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 18.4 t-80 -66.2 -36.92 84.31 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.594 179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -66.56 -35.24 79.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.89 175.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 19' ' ' VAL . 80.8 mt -56.23 -46.04 79.7 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 175.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.9 t -57.32 -50.91 75.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 O-C-N 124.052 0.845 . . . . 0.0 111.165 173.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 68.6 mt-30 -60.57 -32.66 71.74 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -177.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.477 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -78.33 -46.18 20.75 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.959 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.599 HD11 ' CG2' ' B' ' 145' ' ' ILE . 4.7 tt -70.28 -35.21 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.868 0.842 . . . . 0.0 109.621 -177.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 2.0 m-85 -127.01 90.78 48.57 Favored Pre-proline 0 N--CA 1.402 -2.844 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.89 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.503 ' HB2' ' HA2' ' B' ' 134' ' ' GLY . 23.8 Cg_endo -64.98 95.14 0.24 Allowed 'Trans proline' 0 N--CA 1.443 -1.484 0 C-N-CA 121.788 1.659 . . . . 0.0 108.207 174.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.449 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 9.9 t -68.87 136.36 89.91 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.798 -170.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.82 -25.36 10.7 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.213 2.608 . . . . 0.0 111.482 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -149.15 144.49 18.07 Favored Pre-proline 0 CA--C 1.49 -1.361 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.41 -13.45 33.0 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.286 1.991 . . . . 0.0 112.575 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.99 -9.33 58.75 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.0 -0.438 . . . . 0.0 111.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.449 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -79.76 -12.24 59.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.884 0.85 . . . . 0.0 109.034 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.458 ' O ' ' HG2' ' A' ' 40' ' ' MET . 17.3 mt -85.36 5.98 28.43 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.944 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.03 20.66 4.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.626 0.727 . . . . 0.0 109.736 177.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.61 ' O ' ' HB3' ' A' ' 40' ' ' MET . 23.4 t70 -81.65 175.94 10.06 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.85 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.574 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -71.17 -29.82 65.66 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.891 -0.506 . . . . 0.0 111.252 174.256 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -66.16 -23.45 66.47 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.945 0.879 . . . . 0.0 109.158 177.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.645 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.6 tpp -60.38 -36.78 78.88 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.951 176.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.8 pt-20 -61.46 -37.29 83.05 Favored 'General case' 0 C--O 1.2 -1.542 0 C-N-CA 118.444 -1.302 . . . . 0.0 109.672 -178.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -70.7 -43.04 69.84 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 123.727 0.811 . . . . 0.0 111.17 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.28 -43.82 73.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.641 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.645 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.3 p -73.3 -30.83 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.47 -47.11 87.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 175.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.542 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.4 t80 -59.41 -46.78 87.74 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.546 175.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.39 -44.9 93.4 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.182 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -64.11 -42.8 96.74 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 122.938 0.495 . . . . 0.0 111.869 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 35.9 pttt -67.98 -40.13 83.18 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 -178.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 54' ' ' MET . 37.7 t -64.15 -50.47 76.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.933 178.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.6 tm-20 -56.19 -48.5 76.27 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.983 0.802 . . . . 0.0 109.24 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.86 96.28 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.079 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -60.25 -54.31 47.23 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.403 0.62 . . . . 0.0 110.034 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.519 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.3 ptp -67.76 -31.21 70.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.24 -35.72 80.13 Favored 'General case' 0 C--O 1.202 -1.432 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -20.57 37.3 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 121.296 -0.877 . . . . 0.0 111.748 177.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.3 t -80.65 -49.01 11.8 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.54 164.49 13.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -102.57 -5.01 24.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.988 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.2 m -157.81 154.17 27.64 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -63.6 -33.55 75.86 Favored 'General case' 0 C--O 1.195 -1.812 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.493 178.363 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -56.31 -47.49 78.59 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.44 0.638 . . . . 0.0 109.536 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.71 -45.03 80.05 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.753 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -41.01 98.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.636 ' CE1' HD13 ' B' ' 115' ' ' LEU . 8.5 t80 -63.19 -48.47 78.21 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.336 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 25.0 m80 -67.25 -44.8 78.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -70.27 -30.57 67.63 Favored 'General case' 0 C--O 1.254 1.341 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.157 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.472 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.5 OUTLIER -72.27 -41.09 67.12 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -58.3 -35.09 71.32 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 123.616 0.767 . . . . 0.0 111.57 176.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 32.3 mm-40 -70.08 -42.86 72.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.055 0.455 . . . . 0.0 111.122 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.54 -39.51 70.64 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.723 -179.327 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.627 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -67.29 -34.64 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.509 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 2.7 t80 -53.75 -50.88 65.03 Favored 'General case' 0 C--O 1.258 1.525 0 C-N-CA 124.856 1.263 . . . . 0.0 110.756 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.0 ptpt -66.73 -33.66 76.13 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.5 0.5 . . . . 0.0 110.77 -176.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.31 -45.35 98.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 56.6 mt-30 -59.71 -46.52 88.85 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.777 -176.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -79.03 -27.01 43.16 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -59.97 -46.08 90.6 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.704 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.2 pp -68.81 -40.65 79.43 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.127 178.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 47.3 mt-10 -55.57 -52.75 62.7 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 121.11 0.481 . . . . 0.0 110.818 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 9.3 pt-20 -67.1 -39.38 86.7 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.206 -176.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.91 -32.15 63.41 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.344 -178.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 2.0 ppt_? -74.39 -25.14 59.3 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.624 178.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -82.81 -40.54 20.25 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.0 t 78.07 90.39 0.06 Allowed 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.561 1.944 . . . . 0.0 108.314 -176.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.04 -17.06 59.82 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.13 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--N 1.312 -1.04 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.636 -178.091 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 N-CA-C 112.06 -0.416 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 69.7 m 64.12 84.84 0.14 Allowed 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 124.381 1.073 . . . . 0.0 113.257 -177.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.6 ttt 72.72 9.32 5.59 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.814 -1.539 . . . . 0.0 112.92 174.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 15.1 m -65.32 -42.88 92.51 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 35.7 m-70 -119.7 104.89 10.64 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 170.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -111.07 167.04 10.56 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -174.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 93.56 -47.99 2.33 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.521 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 28.8 p-10 -94.57 -12.17 28.05 Favored 'General case' 0 C--N 1.295 -1.798 0 C-N-CA 124.335 1.054 . . . . 0.0 112.035 -176.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -54.77 -37.09 65.56 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 124.268 0.98 . . . . 0.0 112.763 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.441 HG23 HD22 ' B' ' 111' ' ' LEU . 6.5 t -71.83 -32.89 68.0 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 121.054 0.454 . . . . 0.0 110.203 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.441 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -71.13 -41.81 70.03 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 17.4 mm-40 -67.98 -40.92 83.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.33 -178.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.84 -47.99 83.86 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.585 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 tt -55.54 -49.77 71.79 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.636 HD13 ' CE1' ' A' ' 65' ' ' TYR . 51.8 mt -55.89 -67.54 0.28 Allowed 'General case' 0 C--O 1.21 -1.025 0 O-C-N 124.287 0.992 . . . . 0.0 111.451 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 22.5 m -58.82 -38.33 78.42 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.694 -169.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 28.8 m -69.76 -51.77 31.15 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.047 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.54 -33.63 58.55 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.517 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.711 ' HA ' ' NE2' ' A' ' 17' ' ' HIS . 22.6 t -69.75 -54.88 11.65 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -175.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.7 mt -78.04 -30.34 49.84 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -173.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 34.5 t -76.44 -39.83 52.28 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -179.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -91.13 -57.25 2.86 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -171.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 75.1 m 68.77 127.74 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.44 0 O-C-N 123.627 0.58 . . . . 0.0 109.953 -167.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 60.82 20.46 10.62 Favored 'General case' 0 N--CA 1.508 2.47 0 C-N-CA 123.233 0.613 . . . . 0.0 111.428 -170.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . 0.52 ' H ' ' CE1' ' A' ' 17' ' ' HIS . . . -76.29 120.43 5.85 Favored Glycine 0 C--O 1.252 1.245 0 CA-C-N 115.762 -0.653 . . . . 0.0 113.038 -176.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 155.46 121.61 0.75 Allowed Glycine 0 N--CA 1.421 -2.322 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.045 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.34 -68.74 0.36 Allowed Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 39.7 m -93.3 155.42 17.42 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 106.86 -2.38 35.87 Favored Glycine 0 N--CA 1.438 -1.211 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -140.52 -121.02 1.76 Allowed Glycine 0 N--CA 1.438 -1.181 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 86.56 -64.34 3.98 Favored Glycine 0 C--N 1.31 -0.909 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.481 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.1 t -72.36 -11.6 60.76 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 121.418 0.627 . . . . 0.0 110.532 -178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -92.37 25.44 18.02 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 28' ' ' PRO . . . -145.96 -165.52 11.48 Favored Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 130.51 -149.68 19.06 Favored Glycine 0 N--CA 1.435 -1.39 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.3 m -79.9 68.44 6.0 Favored 'General case' 0 C--O 1.25 1.126 0 CA-C-O 121.966 0.888 . . . . 0.0 111.925 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 8.0 mp -105.07 -26.35 12.16 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.715 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.496 ' CD ' ' H ' ' B' ' 139' ' ' CYS . 0.0 OUTLIER -73.11 -61.84 1.67 Allowed 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.812 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . 0.496 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 6.5 p 26.89 -91.89 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.581 1.953 . . . . 0.0 115.564 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.39 -29.56 70.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.047 1.339 . . . . 0.0 110.982 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.704 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 25.0 ttt -64.71 -22.92 67.09 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 123.768 0.827 . . . . 0.0 110.966 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.584 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.9 mt-10 -54.48 -27.18 36.0 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -61.32 -51.0 70.66 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.013 0.435 . . . . 0.0 110.668 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -75.34 -24.35 17.38 Favored 'Isoleucine or valine' 0 C--O 1.249 1.049 0 CA-C-O 122.015 0.912 . . . . 0.0 110.764 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.599 ' CG2' HD11 ' A' ' 26' ' ' ILE . 16.1 mm -65.94 -42.24 91.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.776 172.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -60.37 -40.17 89.87 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 123.861 0.864 . . . . 0.0 108.906 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.2 m -56.12 -45.93 79.33 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 123.553 0.533 . . . . 0.0 110.017 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -71.02 -50.07 38.12 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' B' ' 145' ' ' ILE . 3.2 pp -71.69 -31.5 66.83 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -173.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.454 ' N ' HD12 ' B' ' 149' ' ' LEU . 16.4 tpt -87.61 -18.51 29.49 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.0 t70 64.51 79.66 0.25 Allowed 'General case' 0 C--O 1.241 0.618 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.225 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.416 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.919 -176.553 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.487 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.69 107.08 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.09 107.61 10.18 Favored 'General case' 0 C--N 1.287 -2.15 0 CA-C-O 121.622 0.725 . . . . 0.0 109.429 176.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.0 ptpt -102.95 91.46 4.14 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 122.234 1.016 . . . . 0.0 110.994 176.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -63.9 -6.5 18.5 Favored Glycine 0 C--O 1.235 0.215 0 CA-C-N 114.098 -1.41 . . . . 0.0 115.679 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.462 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.1 p-90 -69.51 -11.27 60.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 117.601 0.701 . . . . 0.0 111.094 177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -60.23 -23.03 63.73 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.936 0.398 . . . . 0.0 111.471 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -79.88 -6.55 57.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.3 0.572 . . . . 0.0 110.512 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -101.05 9.56 42.01 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.788 -178.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.717 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -126.19 111.28 26.05 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.265 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 177.703 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -73.19 150.16 42.33 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.65 -37.99 59.54 Favored 'General case' 0 N--CA 1.441 -0.892 0 O-C-N 123.798 0.686 . . . . 0.0 110.075 176.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 12.4 m-20 -53.17 -44.75 68.11 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 175.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.596 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.57 -54.14 9.99 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 -170.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.1 ptm180 -59.79 -45.27 92.81 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 t -69.68 -25.56 63.95 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.484 0.659 . . . . 0.0 109.947 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.649 ' CE1' ' HA ' ' B' ' 119' ' ' SER . 19.5 t60 -65.92 -46.53 77.88 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.219 176.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -65.87 -34.5 78.29 Favored 'General case' 0 CA--C 1.505 -0.772 0 C-N-CA 119.396 -0.922 . . . . 0.0 110.259 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' ARG . 95.4 t -55.35 -47.32 78.14 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 CA-C-O 121.33 0.586 . . . . 0.0 109.736 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.48 -37.37 82.8 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.145 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HZ3' ' CE1' ' A' ' 17' ' ' HIS . 12.6 mptt -64.54 -37.62 88.18 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.802 175.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 18' ' ' LEU . 94.1 mt -56.67 -45.08 81.91 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.402 HG11 ' HE3' ' A' ' 40' ' ' MET . 55.6 t -60.4 -53.84 43.26 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.934 0 O-C-N 123.508 0.505 . . . . 0.0 110.491 173.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -53.22 -34.72 58.27 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.607 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -79.32 -46.15 18.25 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.675 HD11 HG23 ' B' ' 145' ' ' ILE . 5.5 tt -71.07 -33.25 50.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.311 0.577 . . . . 0.0 110.708 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.418 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 82.6 t80 -124.25 95.4 43.63 Favored Pre-proline 0 N--CA 1.409 -2.516 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.808 -176.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 29.2 Cg_endo -62.37 109.56 0.88 Allowed 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.478 2.118 . . . . 0.0 110.414 173.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.46 HG21 HD21 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -72.82 119.58 76.15 Favored Pre-proline 0 N--CA 1.397 -3.091 0 N-CA-C 115.792 1.775 . . . . 0.0 115.792 -172.278 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.6 -15.19 11.11 Favored 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 122.398 2.065 . . . . 0.0 110.844 176.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.13 143.31 4.4 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.483 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.9 Cg_endo -59.88 -21.0 62.41 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.251 1.967 . . . . 0.0 113.346 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.13 -10.91 60.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.49 -0.756 . . . . 0.0 111.393 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.8 -13.93 59.97 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.682 0.753 . . . . 0.0 110.054 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 32' ' ' PRO . 7.7 mt -88.41 5.34 42.72 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.172 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -133.66 20.42 3.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.892 0.854 . . . . 0.0 109.537 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.649 ' O ' ' HB3' ' A' ' 40' ' ' MET . 13.7 t70 -80.58 172.91 13.15 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.865 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.609 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -72.06 -26.48 62.2 Favored 'General case' 0 C--N 1.309 -1.172 0 O-C-N 121.592 -0.693 . . . . 0.0 110.455 175.259 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -67.57 -25.8 65.97 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.649 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 3.0 tpp -59.92 -41.14 91.08 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.902 -1.044 . . . . 0.0 112.248 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 9.7 pt-20 -64.94 -27.9 69.15 Favored 'General case' 0 C--O 1.206 -1.229 0 C-N-CA 118.648 -1.221 . . . . 0.0 109.916 -177.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -74.03 -45.08 51.97 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 124.117 0.967 . . . . 0.0 110.337 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.99 -41.38 77.92 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.711 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.551 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.7 p -73.49 -30.47 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.29 -44.13 95.65 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 7.0 t80 -60.02 -51.09 71.14 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.203 172.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.21 -43.33 87.61 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.021 0.439 . . . . 0.0 111.223 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -66.25 -46.74 76.05 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 123.571 0.749 . . . . 0.0 111.838 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 12.5 pttp -63.79 -37.0 85.73 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.506 ' O ' ' HG2' ' A' ' 54' ' ' MET . 21.8 t -69.2 -53.15 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.295 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 55' ' ' TYR . 13.5 tm-20 -54.35 -50.5 67.3 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 124.198 0.936 . . . . 0.0 109.718 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.07 99.43 Favored Glycine 0 C--O 1.222 -0.651 0 O-C-N 123.576 0.547 . . . . 0.0 112.441 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -59.38 -52.2 66.64 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.227 0.537 . . . . 0.0 111.374 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.533 ' HB2' HD11 ' A' ' 67' ' ' LEU . 1.5 ptp -71.45 -27.51 63.31 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 40.9 t80 -64.26 -47.45 79.56 Favored 'General case' 0 C--O 1.206 -1.215 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 176.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -71.89 -25.71 62.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.26 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.5 t -80.84 -24.92 38.1 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.18 168.97 12.3 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -109.58 4.72 22.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.653 178.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.8 p -168.95 153.47 5.7 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.717 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -64.74 -33.83 76.9 Favored 'General case' 0 C--O 1.189 -2.109 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.812 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.77 -27.25 63.78 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.276 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.539 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 6.5 tp10 -75.32 -44.68 44.08 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 173.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -39.38 93.62 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.764 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.721 ' OH ' ' HB3' ' B' ' 115' ' ' LEU . 5.2 t80 -65.3 -46.99 78.18 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.069 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -56.4 -57.42 12.38 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 124.2 1.0 . . . . 0.0 111.697 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 63' ' ' GLU . 1.9 pp -69.15 -30.32 68.53 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.52 -39.56 64.7 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -59.69 -38.8 82.57 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.091 176.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.69 -44.07 94.77 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -36.85 72.76 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 119.327 -0.949 . . . . 0.0 111.361 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.596 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.2 tt -69.98 -39.35 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.1 t80 -52.19 -53.29 45.1 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.073 1.349 . . . . 0.0 111.067 174.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -66.33 -34.01 77.02 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.007 -176.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.68 -42.84 93.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 O-C-N 123.426 0.454 . . . . 0.0 111.221 177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.607 ' HG2' ' HB1' ' A' ' 25' ' ' ALA . 47.9 mt-30 -61.21 -48.77 79.99 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 121.414 0.625 . . . . 0.0 110.345 -178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 13.7 ptpt -74.93 -27.7 60.31 Favored 'General case' 0 N--CA 1.394 -3.242 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.506 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -61.31 -47.78 84.4 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.41 ' HB3' ' HG3' ' B' ' 141' ' ' MET . 4.4 pp -69.78 -36.91 76.13 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.465 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.7 OUTLIER -61.72 -53.36 57.04 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.199 0.6 . . . . 0.0 110.96 179.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.1 pt-20 -73.01 -37.38 66.97 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -176.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -72.8 -39.12 66.95 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.215 -175.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.584 ' HG2' HD22 ' B' ' 137' ' ' LEU . 22.8 tpt180 -76.8 -31.73 57.16 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -177.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -62.61 -34.68 77.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.9 t 84.75 88.73 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.027 2.131 . . . . 0.0 110.029 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -80.87 -23.92 38.7 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.531 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--O 1.253 1.261 0 CA-C-N 115.155 -0.929 . . . . 0.0 109.009 173.574 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.129 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 36.3 m -87.98 82.6 7.19 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.156 0.503 . . . . 0.0 110.44 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.94 91.9 8.78 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-O 121.871 0.843 . . . . 0.0 109.018 -179.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 49.2 m -156.33 121.5 4.72 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 177.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 -77.61 131.38 37.77 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -67.73 -27.35 66.73 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 80.41 4.86 90.03 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.522 176.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 37.2 p30 -100.73 13.55 34.52 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.096 0.475 . . . . 0.0 110.697 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -58.32 -57.42 12.97 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.926 -1.034 . . . . 0.0 108.398 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 35.1 m -63.23 -43.23 98.64 Favored 'General case' 0 N--CA 1.422 -1.871 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.751 178.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.83 -57.81 11.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.614 0.571 . . . . 0.0 112.237 -178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 6.5 mm100 -69.19 -36.67 77.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.611 -173.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -64.71 -47.9 76.63 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.261 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.02 -47.59 85.21 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.439 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.721 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 18.3 mt -51.57 -66.41 0.39 Allowed 'General case' 0 C--O 1.214 -0.771 0 O-C-N 124.131 0.895 . . . . 0.0 111.738 177.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 15.0 t -62.56 -35.54 79.81 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -169.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -76.57 -44.35 35.04 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.304 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.477 ' O ' ' HB3' ' B' ' 122' ' ' HIS . 25.5 t70 -76.14 -27.79 57.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.077 0.465 . . . . 0.0 110.642 -175.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.649 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 19.8 t -76.82 -54.95 5.93 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.498 -0.481 . . . . 0.0 112.064 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.3 mt -77.79 -50.16 12.89 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 120.556 -0.458 . . . . 0.0 112.16 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.1 m -77.46 -28.07 52.28 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . 0.477 ' HB3' ' O ' ' B' ' 118' ' ' ASP . 6.7 t-160 -114.09 -8.01 13.04 Favored 'General case' 0 CA--C 1.562 1.423 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -170.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 39.7 t 69.07 -54.59 0.57 Allowed 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.751 1.22 . . . . 0.0 114.279 175.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -128.49 -59.55 1.15 Allowed 'General case' 0 CA--C 1.494 -1.195 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.42 -111.02 1.37 Allowed Glycine 0 C--O 1.242 0.647 0 O-C-N 124.643 1.215 . . . . 0.0 116.124 172.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -66.37 117.92 10.22 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.155 -0.523 . . . . 0.0 112.172 -175.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 169.23 50.69 0.03 OUTLIER Glycine 0 N--CA 1.411 -2.969 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.524 -178.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.0 t -116.97 -58.15 2.1 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 130.35 -169.34 21.26 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 120.367 -0.921 . . . . 0.0 111.433 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 75.67 -134.63 16.67 Favored Glycine 0 N--CA 1.434 -1.448 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 68.02 -123.68 18.65 Favored Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 16.3 m -98.55 -11.23 22.41 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 120.597 0.237 . . . . 0.0 110.819 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -142.89 88.3 0.18 Allowed Glycine 0 CA--C 1.496 -1.12 0 C-N-CA 120.288 -0.958 . . . . 0.0 111.758 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -140.24 76.89 0.32 Allowed Glycine 0 N--CA 1.434 -1.498 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.089 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -175.03 176.23 47.14 Favored Glycine 0 CA--C 1.487 -1.699 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.4 m -73.17 89.77 1.54 Allowed 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.709 0.766 . . . . 0.0 112.163 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.584 HD22 ' HG2' ' A' ' 83' ' ' ARG . 29.0 mt -105.48 -21.8 13.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 176.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' B' ' 142' ' ' GLU . 1.6 pm0 -75.77 -11.63 60.03 Favored 'General case' 0 C--O 1.199 -1.593 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.918 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 9.8 p -55.1 -34.28 63.53 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.455 0.645 . . . . 0.0 111.172 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.94 -33.85 57.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.219 1.009 . . . . 0.0 110.369 175.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.429 ' O ' HG12 ' B' ' 145' ' ' ILE . 92.1 mmm -80.92 -30.81 35.29 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.444 -172.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.673 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 44.9 mt-10 -47.63 -29.85 3.26 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 115.652 1.723 . . . . 0.0 115.652 -173.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 35.0 t -59.3 -59.6 5.2 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 120.878 0.37 . . . . 0.0 110.299 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.8 pp -70.54 -24.32 25.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.615 0.722 . . . . 0.0 111.469 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 26' ' ' ILE . 13.3 mm -66.45 -49.95 71.19 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.604 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 19.1 mtp180 -66.25 -34.89 79.04 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 120.48 0.181 . . . . 0.0 110.902 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 23.7 t -57.22 -43.02 82.43 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 123.935 0.772 . . . . 0.0 109.111 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -77.1 -54.92 5.92 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.188 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.616 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.3 pp -65.17 -26.64 68.25 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 -172.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.4 ' N ' HD12 ' B' ' 149' ' ' LEU . 15.6 tpt -79.36 -23.23 43.5 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 120.068 -0.653 . . . . 0.0 111.379 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.84 110.75 23.15 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.533 -175.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.464 ' HB3' ' HD2' ' A' ' 49' ' ' LYS . . . . . . . . 0 CA--C 1.509 -0.624 0 C-N-CA 126.85 2.06 . . . . 0.0 107.054 175.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.841 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 44.5 t -100.48 131.7 47.54 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -89.48 110.45 21.28 Favored 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 90.5 mttt -99.72 119.55 38.3 Favored 'General case' 0 C--N 1.284 -2.263 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.946 -177.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -50.56 -29.8 18.6 Favored Glycine 0 C--O 1.239 0.456 0 O-C-N 124.292 0.995 . . . . 0.0 115.107 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.419 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 69.3 p-90 -67.48 -7.29 24.41 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -55.84 -30.36 61.33 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.024 0.44 . . . . 0.0 111.354 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -75.84 -10.46 59.45 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.046 0.45 . . . . 0.0 111.173 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -106.78 11.98 29.57 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.205 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.508 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.3 p -128.38 112.2 26.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 121.753 0.787 . . . . 0.0 109.685 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -74.62 150.07 39.78 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.963 -175.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.435 HE21 ' N ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -59.24 -41.98 90.01 Favored 'General case' 0 C--O 1.208 -1.082 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 175.533 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.435 ' N ' HE21 ' A' ' 12' ' ' GLN . 8.2 m-20 -65.02 -29.4 70.31 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.384 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.517 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -74.41 -52.34 12.37 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 -177.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.3 ptm180 -65.87 -42.29 90.56 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.57 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -69.68 -25.83 64.08 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CD2' ' HB3' ' B' ' 119' ' ' SER . 73.0 t60 -66.73 -45.31 79.07 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 121.41 0.624 . . . . 0.0 109.599 175.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.704 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -62.7 -36.8 84.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.232 177.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' ARG . 96.9 t -60.78 -48.75 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.318 0.647 . . . . 0.0 109.65 173.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.487 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 33.0 t-80 -55.12 -45.18 75.54 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.32 0.648 . . . . 0.0 110.767 177.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -66.39 -37.87 86.22 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.871 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.98 -43.16 86.39 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 18.6 t -54.55 -49.64 64.91 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 C-N-CA 123.964 0.906 . . . . 0.0 111.0 173.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -73.95 -15.93 61.1 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 119.655 -0.818 . . . . 0.0 113.112 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.08 -45.67 16.14 Favored 'General case' 0 C--O 1.208 -1.107 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.46 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.563 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.8 tt -70.53 -30.47 42.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 122.417 1.103 . . . . 0.0 109.885 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.486 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 85.3 t80 -134.85 83.37 41.13 Favored Pre-proline 0 N--CA 1.399 -3.007 0 CA-C-N 114.192 -1.367 . . . . 0.0 107.872 -176.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -56.78 94.0 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.381 2.054 . . . . 0.0 108.284 170.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 t -63.78 126.99 91.0 Favored Pre-proline 0 N--CA 1.414 -2.263 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.862 -169.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -72.75 -26.4 16.04 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.78 2.32 . . . . 0.0 111.298 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.4 142.47 14.62 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.88 -25.14 34.11 Favored 'Trans proline' 0 CA--C 1.554 1.485 0 C-N-CA 122.562 2.175 . . . . 0.0 114.559 176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.64 -10.81 59.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.258 -0.902 . . . . 0.0 111.82 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.55 59.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.577 0.703 . . . . 0.0 109.914 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.438 ' O ' ' HG2' ' A' ' 40' ' ' MET . 31.9 mt -87.5 0.38 55.64 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.089 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.86 34.37 3.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 122.002 0.906 . . . . 0.0 110.681 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.662 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.0 t70 -95.32 177.25 5.91 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.454 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.662 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.01 -25.67 62.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 121.723 -0.611 . . . . 0.0 109.778 176.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 13.5 ttm180 -66.24 -24.57 66.62 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.556 175.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.583 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 6.1 tpp -60.57 -43.74 96.95 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.54 -0.754 . . . . 0.0 112.38 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' HA ' HG12 ' A' ' 44' ' ' VAL . 11.3 pt-20 -67.56 -26.43 66.3 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 118.603 -1.239 . . . . 0.0 110.297 -177.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' HD22 ' B' ' 149' ' ' LEU . 5.5 t30 -73.1 -44.89 59.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.744 177.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 77.6 mt -69.78 -41.03 75.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.578 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 41' ' ' GLU . 3.6 p -71.77 -28.18 29.98 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.668 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.2 87.04 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.273 0.559 . . . . 0.0 109.545 175.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.0 t80 -60.95 -45.87 92.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.294 174.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.84 97.92 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.418 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -62.56 -45.62 92.11 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.571 0.749 . . . . 0.0 112.225 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 12.7 pttp -63.91 -37.39 87.21 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.629 0.728 . . . . 0.0 109.354 -177.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 51.0 t -72.22 -47.71 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.321 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.74 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -59.12 -45.24 91.41 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.004 0.922 . . . . 0.0 109.863 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.88 -42.15 99.71 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.937 177.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.97 -54.11 50.59 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.376 0.27 . . . . 0.0 111.32 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.462 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -67.23 -30.98 71.03 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.401 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -59.31 -49.59 77.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -77.34 -21.67 53.01 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.324 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 t -80.97 -35.9 31.54 Favored 'General case' 0 CA--C 1.553 1.075 0 CA-C-O 120.609 0.242 . . . . 0.0 111.498 -178.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -83.58 167.84 16.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.133 0.492 . . . . 0.0 111.499 -178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -121.83 15.1 10.9 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.639 0.733 . . . . 0.0 110.503 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.5 m -156.0 148.92 24.2 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.508 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -68.04 -39.75 83.0 Favored 'General case' 0 C--O 1.191 -1.997 0 CA-C-O 121.034 0.445 . . . . 0.0 111.542 -179.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -67.71 -32.87 73.81 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 123.627 0.771 . . . . 0.0 108.982 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.56 -48.05 70.89 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.617 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -41.28 98.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.565 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -49.26 77.91 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.819 1.248 . . . . 0.0 109.764 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 32.6 m170 -64.1 -49.03 73.85 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.419 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.2 pp -69.62 -30.45 68.18 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.75 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.704 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -74.56 -35.99 63.08 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.524 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.62 -31.79 73.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.1 mm-40 -71.57 -43.2 66.75 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.035 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -71.41 -36.29 71.29 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.331 -179.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.592 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.4 tt -67.23 -39.78 83.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' B' ' 108' ' ' ASN . 26.5 t80 -55.24 -54.66 40.61 Favored 'General case' 0 C--O 1.262 1.716 0 C-N-CA 124.491 1.116 . . . . 0.0 111.291 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 18.1 ptpt -64.42 -34.67 78.73 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.229 -177.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.14 -40.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 O-C-N 123.395 0.434 . . . . 0.0 111.187 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.1 mt-30 -65.76 -52.49 50.57 Favored 'General case' 0 CA--C 1.489 -1.375 0 CA-C-O 121.504 0.669 . . . . 0.0 110.471 -177.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -72.18 -27.93 62.89 Favored 'General case' 0 N--CA 1.399 -2.986 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.31 -178.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -61.62 -51.97 66.3 Favored 'General case' 0 CA--C 1.505 -0.781 0 O-C-N 123.635 0.584 . . . . 0.0 109.631 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -62.39 -40.31 96.07 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.489 -178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.412 ' N ' HD12 ' A' ' 79' ' ' LEU . 3.4 tm-20 -62.62 -49.74 73.98 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 123.366 0.666 . . . . 0.0 110.468 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.5 pt-20 -75.01 -35.49 61.97 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.78 -29.03 60.99 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.572 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -64.12 -46.25 85.02 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 173.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.4 tpp180 -62.69 -37.17 85.4 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.548 175.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . 0.251 49.7 m 86.86 69.57 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 125.891 1.676 . . . . 0.0 113.851 175.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -113.34 -17.43 12.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.45 170.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.117 1.367 . . . . 0.0 107.446 173.904 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.584 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -58.79 -50.32 74.37 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.304 0.642 . . . . 0.0 110.876 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 86.4 mtp -95.9 18.85 12.43 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.213 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.0 t -84.28 -16.93 41.36 Favored 'General case' 0 C--O 1.244 0.802 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -81.0 161.24 24.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -104.36 101.61 11.31 Favored 'General case' 0 C--N 1.291 -1.974 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.47 55.14 4.39 Favored Glycine 0 C--O 1.219 -0.802 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.548 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 31.2 p30 -98.54 2.54 47.61 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 123.671 0.789 . . . . 0.0 111.745 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.73 -46.15 58.99 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -171.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.431 HG23 HD22 ' B' ' 111' ' ' LEU . 5.1 t -65.3 -40.13 93.41 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.579 -0.448 . . . . 0.0 111.613 -177.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.431 HD22 HG23 ' B' ' 110' ' ' THR . 4.5 mm? -73.35 -46.48 48.92 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.226 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -59.22 -42.24 90.53 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 120.967 0.413 . . . . 0.0 110.596 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.48 -43.59 89.75 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.851 176.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.6 tp -55.96 -49.44 73.53 Favored 'General case' 0 C--O 1.264 1.823 0 CA-C-O 121.42 0.628 . . . . 0.0 109.868 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.423 HD23 ' O ' ' B' ' 111' ' ' LEU . 4.1 mm? -53.51 -54.61 34.79 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.302 176.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 33.6 m -60.85 -43.16 98.7 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.273 0.983 . . . . 0.0 110.481 -176.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 40.2 t -58.45 -49.55 76.93 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.414 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -77.13 -52.48 9.2 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 117.679 -1.608 . . . . 0.0 112.828 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.498 ' HB3' ' CD2' ' A' ' 17' ' ' HIS . 77.6 p -77.01 -54.23 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -171.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.2 mt -81.98 -23.46 36.03 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -171.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 41.0 m -68.93 -53.79 19.01 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.508 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -112.74 -71.3 0.76 Allowed 'General case' 0 C--O 1.237 0.425 0 C-N-CA 118.49 -1.284 . . . . 0.0 109.668 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 74.0 p 166.63 97.03 0.0 OUTLIER 'General case' 0 C--O 1.248 1.004 0 C-N-CA 125.18 1.392 . . . . 0.0 107.491 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 20.3 t70 65.8 174.95 0.22 Allowed 'General case' 0 CA--C 1.555 1.16 0 O-C-N 123.683 0.614 . . . . 0.0 110.35 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -147.1 83.67 0.18 Allowed Glycine 0 N--CA 1.414 -2.788 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -68.71 91.73 0.27 Allowed Glycine 0 N--CA 1.436 -1.305 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 178.48 -96.98 0.1 Allowed Glycine 0 N--CA 1.422 -2.282 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.6 t -168.28 150.19 5.21 Favored 'General case' 0 N--CA 1.428 -1.526 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 154.44 104.88 0.24 Allowed Glycine 0 N--CA 1.425 -2.066 0 N-CA-C 109.039 -1.624 . . . . 0.0 109.039 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 156.66 -45.24 0.51 Allowed Glycine 0 C--N 1.289 -2.07 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -175.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.04 104.56 0.19 Allowed Glycine 0 N--CA 1.436 -1.334 0 N-CA-C 111.389 -0.684 . . . . 0.0 111.389 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.0 t -139.24 144.94 38.65 Favored 'General case' 0 N--CA 1.416 -2.167 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 111.51 41.97 1.09 Allowed Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.938 -0.648 . . . . 0.0 111.815 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -107.63 -147.88 13.81 Favored Glycine 0 N--CA 1.435 -1.404 0 N-CA-C 110.733 -0.947 . . . . 0.0 110.733 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 153.12 -42.57 0.65 Allowed Glycine 0 C--N 1.3 -1.448 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.6 m -139.24 8.04 2.44 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 122.369 -0.489 . . . . 0.0 111.885 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 6.5 mp -87.82 -32.43 19.05 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.671 0.748 . . . . 0.0 109.29 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.535 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 1.4 mp0 -62.63 -49.46 75.11 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.624 -1.171 . . . . 0.0 108.591 179.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 8.0 t -73.11 -15.8 61.47 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.36 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -76.48 -38.83 54.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.462 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.0 ttt -80.98 -14.58 57.83 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.722 0.809 . . . . 0.0 110.386 177.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.635 ' HA ' ' HB ' ' B' ' 145' ' ' ILE 0.282 21.0 mt-10 -49.57 -28.03 5.16 Favored 'General case' 0 C--O 1.187 -2.229 0 N-CA-C 116.574 2.064 . . . . 0.0 116.574 -176.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 p -54.79 -60.04 3.91 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 119.167 0.894 . . . . 0.0 111.274 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.429 HD11 ' HG3' ' B' ' 141' ' ' MET . 22.1 pt -68.99 -25.47 30.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.753 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.635 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 17.4 mm -70.87 -40.52 76.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.196 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.747 177.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 24.5 mmm180 -60.83 -47.8 84.7 Favored 'General case' 0 CA--C 1.498 -1.019 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.4 p -60.11 -38.25 82.42 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 119.564 -0.854 . . . . 0.0 111.747 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.599 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 55.2 mm-40 -66.17 -57.56 7.36 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 175.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.479 HD23 HG22 ' B' ' 145' ' ' ILE . 4.3 pp -61.48 -23.75 66.1 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -173.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.407 ' HG3' HD12 ' B' ' 149' ' ' LEU . 70.0 mtm -86.47 -6.54 58.88 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.796 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -130.04 109.19 10.66 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-O 121.954 0.883 . . . . 0.0 112.968 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.618 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 174.621 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.455 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.407 HG13 ' HG2' ' A' ' 56' ' ' GLU . 5.2 m -131.26 108.01 14.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.019 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.44 70.55 1.98 Allowed 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 123.159 1.457 . . . . 0.0 107.849 172.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 77.5 mttt -128.55 118.91 23.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.611 -1.631 . . . . 0.0 107.904 -175.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -50.31 -30.44 18.31 Favored Glycine 0 CA--C 1.524 0.647 0 O-C-N 124.119 0.887 . . . . 0.0 114.678 -174.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.499 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 65.8 p-90 -71.31 -5.68 34.16 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -176.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.574 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 25.4 p80 -70.51 -11.89 61.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.91 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 13.1 pt-20 -90.71 -6.83 53.96 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.989 175.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.499 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 17.7 m-70 -95.08 5.88 50.62 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.408 0.683 . . . . 0.0 110.044 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.546 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.4 p -133.07 121.46 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 m -77.91 149.88 34.15 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -36.1 79.79 Favored 'General case' 0 C--O 1.205 -1.242 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 9.6 m-20 -66.02 -29.26 69.6 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.2 tm? -73.22 -51.55 17.29 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -177.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.518 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.3 ptm180 -65.14 -43.07 93.05 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.106 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.43 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 38.9 t -64.68 -28.83 69.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 121.464 0.649 . . . . 0.0 109.288 178.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -67.23 -43.86 80.93 Favored 'General case' 0 N--CA 1.422 -1.85 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.637 176.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.501 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -63.46 -37.45 87.33 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.313 176.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 15' ' ' ARG . 89.7 t -55.03 -47.05 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.423 0.689 . . . . 0.0 109.595 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.462 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 13.2 t-80 -63.31 -37.05 85.75 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.313 178.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.66 -32.65 66.0 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 118.891 -1.124 . . . . 0.0 111.783 176.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.4 mt -57.06 -43.68 82.27 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 173.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 23.4 t -57.63 -46.79 86.45 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.1 172.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 34.6 mt-30 -69.96 -31.16 68.73 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.529 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -73.36 -45.9 52.31 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.441 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.583 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.3 tt -70.85 -33.74 53.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 CA-C-O 121.393 0.616 . . . . 0.0 110.781 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.436 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 68.5 t80 -127.02 81.74 69.35 Favored Pre-proline 0 N--CA 1.418 -2.074 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.717 -174.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.438 ' HG3' ' HB2' ' B' ' 137' ' ' LEU . 10.7 Cg_endo -53.57 120.15 7.36 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.346 2.697 . . . . 0.0 109.358 169.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.5 112.72 4.54 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 -170.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.38 -12.42 9.12 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 121.82 1.68 . . . . 0.0 108.498 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.539 ' HA ' ' O ' ' B' ' 131' ' ' GLY . 6.3 t70 -176.83 137.56 0.43 Allowed Pre-proline 0 CA--C 1.496 -1.126 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.93 -22.19 73.66 Favored 'Trans proline' 0 N--CA 1.45 -1.061 0 C-N-CA 121.989 1.793 . . . . 0.0 112.158 174.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.88 -3.47 57.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.914 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.07 -10.72 59.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.107 0.956 . . . . 0.0 108.453 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.84 5.4 25.28 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.627 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.6 16.92 3.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.638 0.733 . . . . 0.0 110.351 175.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 30.0 t70 -83.19 179.1 7.82 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.806 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -69.86 -26.76 64.36 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.51 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 12.1 ttm180 -68.03 -21.01 65.04 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.58 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 9.0 tpp -63.44 -44.01 95.77 Favored 'General case' 0 C--O 1.206 -1.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.315 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.1 pt-20 -62.62 -30.02 71.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 119.347 -0.941 . . . . 0.0 109.73 -177.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.429 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.9 t30 -71.41 -47.65 54.69 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 124.57 1.148 . . . . 0.0 110.309 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 82.5 mt -69.11 -41.8 76.93 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.391 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.509 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -73.32 -27.82 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.561 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.78 77.12 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.581 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 3.1 t80 -56.23 -42.41 77.25 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.108 0.563 . . . . 0.0 109.889 173.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.84 -42.52 85.61 Favored 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.083 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -64.44 -42.48 95.97 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.508 0.323 . . . . 0.0 111.638 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.581 ' HG3' ' O ' ' A' ' 46' ' ' TYR . 5.1 ptmt -63.02 -44.81 94.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.244 176.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 52.7 t -63.66 -50.04 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.602 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -56.28 -46.7 79.61 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 109.201 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.559 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . -59.53 -44.06 97.07 Favored Glycine 0 N--CA 1.443 -0.847 0 O-C-N 123.945 0.778 . . . . 0.0 112.335 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -56.69 -54.36 47.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 122.787 0.435 . . . . 0.0 110.838 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.436 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -68.22 -31.97 71.85 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.574 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 83.9 t80 -61.74 -46.35 90.01 Favored 'General case' 0 C--N 1.309 -1.185 0 C-N-CA 123.703 0.801 . . . . 0.0 109.848 177.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 52' ' ' GLY . 35.5 mt-10 -80.1 -22.75 41.84 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.016 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.404 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 46.4 m -76.35 -30.61 57.69 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.86 167.27 15.31 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -115.04 7.43 15.5 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.47 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.446 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 70.0 m -159.97 153.66 22.71 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.546 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -71.16 -36.63 72.08 Favored 'General case' 0 C--O 1.179 -2.617 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -177.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 5.2 p-10 -70.07 -27.29 64.5 Favored 'General case' 0 C--N 1.29 -1.982 0 C-N-CA 124.17 0.988 . . . . 0.0 108.792 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.46 -46.75 46.42 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -42.19 99.28 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.501 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 1.2 t80 -55.0 -49.5 71.36 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.317 1.447 . . . . 0.0 109.591 174.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -64.49 -53.97 39.72 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.169 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.436 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -69.03 -30.02 68.3 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.94 -176.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 65' ' ' TYR . 1.0 OUTLIER -70.4 -39.53 74.42 Favored 'General case' 0 C--N 1.347 0.476 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.02 -34.43 77.56 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 123.567 0.542 . . . . 0.0 110.096 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -71.08 -38.71 72.42 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.636 176.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -76.24 -35.46 58.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 118.976 -1.09 . . . . 0.0 111.236 -179.269 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.616 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.3 tt -67.75 -36.91 77.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.564 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.5 t80 -53.23 -53.01 56.95 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.133 1.373 . . . . 0.0 111.263 174.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.3 ptpt -67.84 -31.97 72.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.784 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.48 -43.38 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 O-C-N 123.402 0.439 . . . . 0.0 110.09 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 54.2 mt-30 -62.9 -54.28 41.04 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.093 -177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 13.4 ptpt -68.54 -27.87 66.48 Favored 'General case' 0 N--CA 1.398 -3.063 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.431 -176.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 5.7 tm-20 -62.88 -52.57 62.58 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 177.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.516 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -64.31 -38.06 89.69 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.66 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.88 -41.37 87.34 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 123.489 0.493 . . . . 0.0 111.686 178.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.2 pt-20 -72.7 -42.65 63.97 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -178.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.469 ' HE2' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.86 -34.91 64.67 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 83' ' ' ARG . 2.2 mmp_? -72.43 -49.89 30.28 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -69.52 -35.57 75.61 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.3 m 72.78 72.8 0.14 Allowed 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.6 -1.636 . . . . 0.0 109.888 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -93.76 -10.75 33.2 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.58 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.254 1.337 0 CA-C-N 114.235 -1.348 . . . . 0.0 109.919 -178.59 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.807 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 38.6 t -112.15 142.72 44.27 Favored 'General case' 0 N--CA 1.418 -2.04 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 65.0 mtt -105.67 15.57 26.69 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.0 m -84.28 92.56 8.02 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.315 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -94.26 102.85 14.88 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -150.91 173.78 13.88 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -177.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.02 53.67 9.06 Favored Glycine 0 CA--C 1.498 -1.008 0 N-CA-C 110.319 -1.113 . . . . 0.0 110.319 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 39.1 p-10 -118.1 17.4 14.05 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.125 -1.038 . . . . 0.0 109.711 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.94 -50.17 58.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.8 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -63.76 -43.9 95.05 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 122.735 0.414 . . . . 0.0 110.34 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 3.2 mm? -63.56 -52.45 61.03 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.209 -177.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' B' ' 112' ' ' GLN . 13.0 mt-30 -68.79 -44.32 73.86 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.229 -178.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.56 -41.11 98.43 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.353 0.408 . . . . 0.0 110.977 -178.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.49 -45.87 87.81 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 49.1 mt -57.73 -58.55 7.84 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.102 177.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.7 m -55.32 -38.95 69.37 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.307 0.575 . . . . 0.0 111.167 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' B' ' 121' ' ' SER . 28.2 p -77.63 -43.8 30.32 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.566 -175.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' B' ' 122' ' ' HIS . 20.3 t0 -74.64 -37.62 62.73 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.624 -176.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' B' ' 123' ' ' SER . 68.3 p -76.78 -53.72 7.56 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -177.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 92.9 mt -82.08 -54.08 5.58 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.952 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' B' ' 117' ' ' SER . 13.7 m -72.56 -47.8 45.25 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -177.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . 0.508 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 47.7 m170 -81.64 -49.38 10.56 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 110.823 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' B' ' 119' ' ' SER . 50.4 m 74.86 -63.01 0.44 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.391 1.476 . . . . 0.0 112.528 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -111.69 148.62 33.04 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 116.789 -0.187 . . . . 0.0 110.808 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 155.55 73.93 0.01 OUTLIER Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -132.52 150.84 19.77 Favored Glycine 0 C--N 1.304 -1.243 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.252 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 83.37 -10.28 59.28 Favored Glycine 0 C--N 1.314 -0.668 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.788 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 22.6 t -133.64 131.11 39.19 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 171.06 -155.77 25.23 Favored Glycine 0 N--CA 1.43 -1.728 0 N-CA-C 109.394 -1.483 . . . . 0.0 109.394 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -102.83 154.51 18.28 Favored Glycine 0 C--N 1.307 -1.036 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.912 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . 0.539 ' O ' ' HA ' ' A' ' 31' ' ' ASP . . . 136.77 108.99 0.92 Allowed Glycine 0 N--CA 1.429 -1.78 0 N-CA-C 111.721 -0.552 . . . . 0.0 111.721 178.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 12.7 p -126.65 11.25 7.28 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 122.01 0.91 . . . . 0.0 109.905 175.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 110.17 -171.44 14.84 Favored Glycine 0 N--CA 1.424 -2.161 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.63 -10.4 45.35 Favored Glycine 0 C--N 1.314 -0.66 0 CA-C-N 117.372 0.586 . . . . 0.0 112.662 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -148.71 36.59 1.06 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 108.912 -1.675 . . . . 0.0 108.912 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.4 ' HB2' ' OE1' ' B' ' 138' ' ' GLU . 6.4 p -94.68 92.81 7.19 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 122.104 0.954 . . . . 0.0 109.904 -179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.438 ' HB2' ' HG3' ' A' ' 28' ' ' PRO . 9.2 mp -84.04 -15.05 48.96 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.679 -1.146 . . . . 0.0 112.433 -177.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.436 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -55.81 -37.81 69.14 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.033 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -70.68 75.59 0.59 Allowed 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 121.499 0.666 . . . . 0.0 111.108 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 61.7 t0 164.27 -59.6 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 128.007 2.523 . . . . 0.0 105.26 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.668 ' SD ' HD11 ' B' ' 144' ' ' ILE . 14.0 tpt -58.05 -37.09 73.73 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 113.964 -1.471 . . . . 0.0 109.827 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 24.6 tt0 -53.97 -27.15 29.55 Favored 'General case' 0 CA--C 1.567 1.627 0 C-N-CA 124.793 1.237 . . . . 0.0 112.298 -177.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 8.9 m -63.27 -59.41 4.76 Favored 'General case' 0 C--O 1.276 2.46 0 CA-C-O 121.282 0.563 . . . . 0.0 110.756 178.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.668 HD11 ' SD ' ' B' ' 141' ' ' MET . 46.7 pt -62.95 -28.53 45.23 Favored 'Isoleucine or valine' 0 C--N 1.354 0.773 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.583 ' CG2' HD11 ' A' ' 26' ' ' ILE . 10.6 mm -65.27 -43.69 95.15 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.839 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.1 177.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.432 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 74.9 mtt85 -63.55 -40.94 98.3 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 119.97 -0.692 . . . . 0.0 111.689 176.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 4.8 p -66.6 -26.21 66.98 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.383 176.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -80.59 -49.82 10.8 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.864 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.7 pp -67.39 -29.22 68.68 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.67 -0.644 . . . . 0.0 111.446 -176.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 39.2 tpp -67.36 -29.26 68.75 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.17 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -96.92 116.25 28.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.555 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -179.959 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.189 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.1 t -84.13 111.12 19.57 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -79.3 118.76 21.51 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.955 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.609 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 46.0 mttp -118.73 99.64 6.9 Favored 'General case' 0 C--N 1.284 -2.253 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -55.9 -22.88 36.11 Favored Glycine 0 C--O 1.247 0.915 0 O-C-N 123.968 0.792 . . . . 0.0 114.134 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.609 ' NE1' ' HB3' ' A' ' 4' ' ' LYS . 66.5 p-90 -64.17 -10.06 20.71 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -60.24 -27.71 67.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.992 0.425 . . . . 0.0 111.24 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.59 -5.45 59.27 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.105 0.478 . . . . 0.0 111.062 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -96.52 -24.75 15.92 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.554 0.692 . . . . 0.0 110.153 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.551 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.3 p -96.71 124.36 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.661 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.749 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 m -86.08 151.62 23.54 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.061 -176.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.51 -42.21 78.0 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 122.996 0.519 . . . . 0.0 110.291 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -61.45 -31.74 71.7 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.602 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -72.64 -52.32 15.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 -174.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.454 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.5 ptm180 -62.58 -45.99 90.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.96 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 m -67.13 -23.48 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.033 0.444 . . . . 0.0 110.561 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 25.4 t60 -68.59 -45.18 72.71 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.602 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -62.19 -38.69 90.07 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.674 177.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.462 ' HA ' HD12 ' A' ' 22' ' ' LEU . 94.2 t -54.72 -47.77 73.27 Favored 'Isoleucine or valine' 0 C--O 1.256 1.4 0 C-N-CA 123.138 0.575 . . . . 0.0 110.235 176.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -58.64 -44.75 90.16 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.132 178.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -71.13 -29.75 65.64 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 179.025 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.1 mt -56.99 -45.17 83.18 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 175.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.567 HG11 ' HE1' ' A' ' 40' ' ' MET . 15.3 t -61.95 -51.44 72.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 O-C-N 123.799 0.687 . . . . 0.0 111.436 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.521 ' HB3' ' H ' ' B' ' 129' ' ' GLY . 23.5 mm-40 -63.97 -25.81 68.3 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.341 -175.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.518 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.34 -45.52 16.04 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.587 176.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.539 HD11 HG21 ' B' ' 145' ' ' ILE . 3.2 tt -70.57 -31.0 44.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.523 0.677 . . . . 0.0 109.391 -177.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.447 ' CD2' ' HG2' ' B' ' 138' ' ' GLU . 1.5 m-85 -127.93 90.43 47.73 Favored Pre-proline 0 N--CA 1.407 -2.616 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.086 -176.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 28.6 Cg_endo -65.09 104.31 0.58 Allowed 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 121.848 1.698 . . . . 0.0 108.156 171.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.43 117.65 17.85 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 118.203 2.668 . . . . 0.0 118.203 -168.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -80.05 -19.52 9.39 Favored 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 122.468 2.112 . . . . 0.0 110.251 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -156.94 144.65 14.02 Favored Pre-proline 0 CA--C 1.483 -1.601 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.95 -12.47 26.1 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.145 1.23 . . . . 0.0 110.167 174.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.04 -13.75 60.9 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.069 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -21.66 63.38 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.67 0.748 . . . . 0.0 109.601 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.41 2.11 54.92 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.346 -178.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -136.09 19.01 3.21 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.529 0.681 . . . . 0.0 110.222 173.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.554 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 18.1 t70 -88.61 -179.37 6.02 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -176.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.554 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.88 -28.25 64.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 174.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.6 -23.14 66.76 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.567 ' HE1' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -62.66 -40.61 97.6 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 179.097 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -65.56 -36.97 85.34 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.526 -178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.48 -43.67 93.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.504 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.51 -43.35 63.7 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.168 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.52 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 p -73.47 -34.35 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.812 -179.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.13 95.15 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 175.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -61.54 -48.63 80.14 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.787 173.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.29 96.78 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 96.8 mttt -67.07 -45.04 78.54 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.259 0.624 . . . . 0.0 111.764 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' B' ' 149' ' ' LEU . 16.0 pttp -64.69 -40.24 95.06 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 54' ' ' MET . 20.7 t -64.91 -51.43 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.229 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.267 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -54.33 -51.31 65.12 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.932 0.893 . . . . 0.0 109.967 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -36.56 93.59 Favored Glycine 0 CA--C 1.52 0.385 0 CA-C-N 116.295 -0.411 . . . . 0.0 113.131 -179.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -58.86 -54.32 48.39 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.793 0.806 . . . . 0.0 108.829 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.621 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.4 ptp -74.31 -28.43 61.16 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.519 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.4 ' HA ' ' CD1' ' A' ' 64' ' ' TYR . 72.5 t80 -59.23 -52.43 65.71 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 174.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -71.82 -27.86 63.2 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.123 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -71.72 -22.63 61.6 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 122.599 0.36 . . . . 0.0 111.638 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.02 168.31 10.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-O 121.446 0.641 . . . . 0.0 112.3 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -121.13 13.85 11.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.469 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -156.71 151.48 25.85 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.551 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.8 -36.5 67.59 Favored 'General case' 0 C--O 1.179 -2.614 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.554 177.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.25 -30.52 70.98 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 12.9 tp10 -71.75 -48.08 49.3 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.625 176.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.4 ' CD1' ' HA ' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -61.9 -39.4 91.87 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.602 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.522 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.5 OUTLIER -58.79 -48.23 82.01 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 124.604 1.161 . . . . 0.0 109.131 173.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -64.49 -55.62 19.52 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 122.921 0.488 . . . . 0.0 110.375 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.621 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -64.84 -30.45 71.45 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.55 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -76.1 -38.52 56.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.041 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.519 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.08 -36.25 82.96 Favored 'General case' 0 C--O 1.19 -2.069 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -64.71 -44.22 90.95 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.122 0.969 . . . . 0.0 112.407 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -72.87 -35.31 67.15 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.973 -178.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.631 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 6.5 tt -72.02 -35.67 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.585 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 1.2 t80 -54.16 -52.52 60.87 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 125.799 1.64 . . . . 0.0 110.818 174.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -67.29 -35.1 78.79 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.544 0.528 . . . . 0.0 110.584 -177.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.75 -42.18 95.07 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 53.6 mt-30 -63.59 -49.6 72.71 Favored 'General case' 0 CA--C 1.492 -1.278 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.1 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.607 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.4 ptpt -73.46 -29.4 62.51 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.939 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.2 tp10 -58.98 -52.45 65.7 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.69 -39.06 84.44 Favored 'General case' 0 C--O 1.258 1.526 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.942 -178.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 0.5 OUTLIER -63.39 -52.98 59.36 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.246 -179.382 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.0 pt-20 -69.74 -34.15 73.45 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -33.92 77.02 Favored 'General case' 0 C--N 1.347 0.481 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.088 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -77.35 -51.66 10.47 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.15 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -70.48 -60.38 2.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -171.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m -166.1 95.09 0.57 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -172.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HG3' ' HG ' ' A' ' 87' ' ' LEU . 30.4 ptt180 -178.34 -35.88 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 124.246 1.018 . . . . 0.0 109.108 169.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.44 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 78.0 mt . . . . . 0 C--O 1.259 1.568 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.651 0 N-CA-C 111.32 -0.712 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.5 m -137.3 152.09 49.38 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.104 -0.548 . . . . 0.0 110.473 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 14.7 tpt -130.42 80.77 1.97 Allowed 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 5.1 p -90.49 -36.02 14.76 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.712 -1.131 . . . . 0.0 112.06 -174.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -95.74 97.43 9.69 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -126.44 94.98 4.22 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-O 122.016 0.912 . . . . 0.0 109.682 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -108.15 -12.31 22.19 Favored Glycine 0 N--CA 1.437 -1.274 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -79.28 14.32 1.57 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -176.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -51.02 -57.72 7.89 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 124.909 1.284 . . . . 0.0 111.227 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.2 m -57.01 -43.72 82.07 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.936 -178.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 2.9 mm? -69.61 -52.22 27.99 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.505 -175.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -66.16 -43.98 85.41 Favored 'General case' 0 CA--C 1.503 -0.846 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.199 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.99 -43.96 97.74 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 123.68 0.612 . . . . 0.0 110.814 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 59.1 tp -59.36 -45.02 92.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.119 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 111' ' ' LEU . 66.5 mt -57.03 -62.95 1.39 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.522 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 12.2 t -60.49 -32.77 71.75 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 120.909 0.385 . . . . 0.0 111.722 -174.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 36.9 m -71.74 -49.14 41.83 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.322 0.582 . . . . 0.0 110.329 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.635 ' O ' ' HB3' ' B' ' 122' ' ' HIS . 23.3 t70 -76.06 -30.22 58.29 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.536 -175.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.467 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 22.8 t -78.31 -55.2 5.43 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.92 -47.9 12.16 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -171.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.7 m -74.7 -38.64 62.31 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.059 -178.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' B' ' 118' ' ' ASP . 48.8 t60 -93.0 -7.81 44.8 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -175.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 47.4 t 74.23 -68.25 0.22 Allowed 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.496 1.118 . . . . 0.0 112.06 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -169.31 162.9 10.65 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 -175.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 167.34 -149.6 15.15 Favored Glycine 0 N--CA 1.414 -2.784 0 C-N-CA 119.789 -1.195 . . . . 0.0 112.253 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -113.78 45.63 1.29 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 111.556 -0.618 . . . . 0.0 111.556 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -66.09 95.11 0.23 Allowed Glycine 0 CA--C 1.508 -0.404 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.0 m -89.34 147.53 24.03 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 120.801 0.334 . . . . 0.0 110.203 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . 0.521 ' H ' ' HB3' ' A' ' 24' ' ' GLN . . . -115.91 158.92 14.12 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 110.739 -0.944 . . . . 0.0 110.739 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 110.26 -78.3 0.24 Allowed Glycine 0 N--CA 1.416 -2.635 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 178.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 83.7 -61.61 4.72 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 108.875 -1.69 . . . . 0.0 108.875 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.9 p -82.74 82.84 7.91 Favored 'General case' 0 N--CA 1.407 -2.588 0 CA-C-O 121.661 0.743 . . . . 0.0 109.563 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -137.09 136.4 8.28 Favored Glycine 0 N--CA 1.424 -2.148 0 N-CA-C 109.314 -1.515 . . . . 0.0 109.314 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 144.35 -55.46 0.56 Allowed Glycine 0 C--N 1.293 -1.86 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -83.11 80.92 1.78 Allowed Glycine 0 CA--C 1.493 -1.301 0 N-CA-C 107.171 -2.372 . . . . 0.0 107.171 172.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.526 ' HA ' ' OE2' ' B' ' 138' ' ' GLU . 73.4 m -33.35 111.39 0.1 Allowed 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -170.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 4.0 mp -96.93 -21.42 17.46 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.044 -1.889 . . . . 0.0 106.15 173.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.526 ' OE2' ' HA ' ' B' ' 136' ' ' SER . 1.3 mp0 -60.72 -41.93 96.24 Favored 'General case' 0 C--O 1.184 -2.368 0 CA-C-N 114.099 -1.41 . . . . 0.0 110.771 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 66.4 m -49.24 -48.4 45.73 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -174.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.14 -32.91 67.34 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.775 0.798 . . . . 0.0 109.559 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.484 ' SD ' HD11 ' B' ' 144' ' ' ILE . 11.1 tpt -70.6 -38.67 74.01 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.833 -176.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.563 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 48.4 mt-10 -53.22 -27.24 20.94 Favored 'General case' 0 C--O 1.202 -1.411 0 C-N-CA 124.823 1.249 . . . . 0.0 113.716 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.9 m -65.07 -57.33 8.9 Favored 'General case' 0 C--O 1.263 1.795 0 CA-C-O 121.274 0.559 . . . . 0.0 110.184 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.484 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.9 pp -72.55 -25.49 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.711 0.767 . . . . 0.0 110.563 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.563 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 12.6 mm -71.14 -33.5 51.37 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.807 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.459 173.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -62.53 -44.72 95.66 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -58.61 -50.74 72.72 Favored 'General case' 0 CA--C 1.558 1.251 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.123 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.01 -47.05 87.44 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.773 1.229 . . . . 0.0 112.956 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.572 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.2 pp -71.0 -30.89 67.25 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 121.85 -0.531 . . . . 0.0 111.546 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 51.7 tpp -76.09 -53.25 8.6 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.502 -178.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -112.54 -75.01 0.61 Allowed 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.202 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 179.896 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.391 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -85.76 141.16 14.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 122.247 -0.561 . . . . 0.0 110.024 177.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.518 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -97.08 119.13 35.0 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.011 -178.546 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -113.9 137.01 52.26 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -50.53 -31.4 21.71 Favored Glycine 0 N--CA 1.465 0.62 0 O-C-N 124.157 0.911 . . . . 0.0 115.309 -173.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.6 p-90 -70.95 -5.04 27.9 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -63.29 -17.27 62.34 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.25 0.547 . . . . 0.0 111.048 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.29 -22.2 61.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.04 0.448 . . . . 0.0 110.393 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -96.45 3.06 53.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG23 HD12 ' A' ' 14' ' ' LEU . 7.3 p -134.07 117.23 24.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 CA-C-O 121.692 0.758 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -97.35 168.38 10.44 Favored 'General case' 0 N--CA 1.402 -2.828 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.409 HE21 ' HB3' ' A' ' 12' ' ' GLN . 3.2 tt0 -56.75 -45.82 81.8 Favored 'General case' 0 C--O 1.198 -1.641 0 O-C-N 124.659 1.225 . . . . 0.0 109.667 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 5.5 p-10 -55.49 -37.46 67.85 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD12 HG23 ' A' ' 10' ' ' VAL . 3.3 tm? -73.4 -48.54 33.11 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.444 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.7 ptm180 -69.2 -41.68 76.81 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.805 -1.089 . . . . 0.0 112.447 -177.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.0 t -71.78 -23.63 61.61 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.581 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 16.7 t60 -72.34 -39.76 67.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.504 HD23 HD21 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -67.3 -35.58 79.75 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.847 175.426 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.7 t -58.92 -40.33 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 172.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -62.55 -44.13 97.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.859 179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 4.6 mptp? -68.89 -35.93 77.47 Favored 'General case' 0 CA--C 1.503 -0.837 0 C-N-CA 120.204 -0.598 . . . . 0.0 112.321 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 19' ' ' VAL . 66.1 mt -54.84 -43.37 72.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.2 t -62.29 -50.44 79.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.55 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -66.01 -22.34 66.45 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.903 -176.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.84 -46.23 14.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 177.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.556 HD11 ' CG2' ' B' ' 145' ' ' ILE . 3.6 tt -70.88 -29.33 36.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.604 0 CA-C-O 122.294 1.045 . . . . 0.0 108.891 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.551 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 87.9 t80 -129.05 89.31 48.95 Favored Pre-proline 0 N--CA 1.391 -3.385 0 CA-C-N 113.828 -1.533 . . . . 0.0 108.858 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.44 ' HG2' ' HG3' ' B' ' 138' ' ' GLU . 10.2 Cg_endo -52.89 129.51 33.3 Favored 'Trans proline' 0 N--CA 1.444 -1.395 0 C-N-CA 121.954 1.769 . . . . 0.0 108.446 170.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' HD21 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -86.23 117.54 68.86 Favored Pre-proline 0 N--CA 1.408 -2.547 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -169.079 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -78.43 -23.93 8.18 Favored 'Trans proline' 0 N--CA 1.443 -1.479 0 N-CA-C 108.995 -1.194 . . . . 0.0 108.995 172.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -170.25 145.13 2.23 Favored Pre-proline 0 N--CA 1.44 -0.936 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.423 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -57.51 -20.39 40.94 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.832 2.355 . . . . 0.0 113.596 175.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -77.67 -11.52 59.88 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.064 -1.022 . . . . 0.0 112.555 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.17 -6.43 57.76 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.74 0.781 . . . . 0.0 109.129 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.2 mt -89.92 7.2 38.52 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.716 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 17.9 ptpt -129.88 15.41 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.93 0.871 . . . . 0.0 109.187 175.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 40' ' ' MET . 27.7 t70 -81.75 176.38 9.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.748 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.82 -27.47 63.9 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.034 0.445 . . . . 0.0 110.718 178.503 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.603 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.1 ttp180 -72.98 -17.1 61.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.632 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 4.4 tpp -63.08 -45.48 91.93 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.138 176.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.06 -31.16 72.24 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.711 -175.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.6 t30 -67.56 -49.18 64.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.375 1.47 . . . . 0.0 110.021 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 76.9 mt -67.78 -44.62 76.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.458 -177.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.504 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 6.4 p -71.81 -30.32 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.346 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.167 -177.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.18 -48.69 80.66 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.559 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.2 t80 -59.06 -46.64 87.74 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.468 174.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.16 95.23 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.583 0.23 . . . . 0.0 110.915 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -63.68 -46.28 86.25 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.367 0.667 . . . . 0.0 112.277 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -61.82 -41.35 97.67 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.41 -51.68 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.331 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -57.62 -48.61 78.96 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.848 0.859 . . . . 0.0 109.723 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.93 -40.25 95.1 Favored Glycine 0 N--CA 1.451 -0.356 0 O-C-N 123.762 0.664 . . . . 0.0 112.619 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.57 -54.87 40.24 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.351 0.26 . . . . 0.0 111.146 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.492 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.3 OUTLIER -68.68 -29.68 68.19 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -62.42 -48.49 79.45 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -79.43 -16.63 55.83 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.492 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 38.8 m -84.43 -23.32 30.04 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.23 165.74 12.96 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -107.99 2.73 23.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.584 178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 80.5 p -162.75 159.61 24.39 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.436 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.33 -35.36 68.58 Favored 'General case' 0 C--O 1.194 -1.822 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.973 -176.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.58 -35.31 78.76 Favored 'General case' 0 C--O 1.209 -1.06 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -65.03 -47.05 78.78 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.717 174.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -43.37 98.48 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -57.95 -48.74 79.07 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 124.728 1.211 . . . . 0.0 109.512 175.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -64.05 -49.91 70.49 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.291 0.369 . . . . 0.0 111.575 -176.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.408 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.6 pp -70.13 -30.39 67.56 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.932 -177.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.504 HD21 HD23 ' A' ' 18' ' ' LEU . 0.6 OUTLIER -71.43 -42.21 68.53 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.494 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.31 -35.0 74.58 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 123.363 0.665 . . . . 0.0 110.338 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 5.0 mm-40 -66.82 -48.38 69.13 Favored 'General case' 0 C--O 1.26 1.632 0 C-N-CA 123.444 0.698 . . . . 0.0 112.243 175.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.88 -37.61 70.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.904 -0.718 . . . . 0.0 110.914 -178.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.669 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -66.23 -37.75 80.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.895 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 6.8 t80 -52.59 -54.05 38.28 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 125.232 1.413 . . . . 0.0 111.193 174.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.2 ptpt -65.46 -32.41 74.0 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.097 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.6 mp -65.41 -43.59 94.67 Favored 'Isoleucine or valine' 0 C--O 1.243 0.743 0 CA-C-O 120.624 0.25 . . . . 0.0 110.508 177.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 63.7 mt-30 -63.29 -53.83 46.74 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.102 -175.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.0 ptpt -70.07 -28.78 65.71 Favored 'General case' 0 N--CA 1.395 -3.214 0 C-N-CA 119.366 -0.934 . . . . 0.0 112.023 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.7 tp10 -59.77 -51.7 68.61 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.662 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 4.5 pp -63.31 -44.42 95.0 Favored 'General case' 0 C--O 1.255 1.371 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.979 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 7.5 pt-20 -72.05 -40.24 68.51 Favored 'General case' 0 C--O 1.195 -1.808 0 C-N-CA 119.024 -1.071 . . . . 0.0 113.158 -177.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.2 pt-20 -72.8 -32.97 65.94 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 119.497 1.044 . . . . 0.0 111.681 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.446 ' HA ' ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -69.28 -29.43 67.32 Favored 'General case' 0 CA--C 1.493 -1.245 0 C-N-CA 119.314 -0.955 . . . . 0.0 110.401 177.02 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -77.73 -45.43 24.74 Favored 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.135 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.5 ttm-85 -82.91 -59.5 2.47 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 115.384 1.624 . . . . 0.0 115.384 -167.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 12.3 p -158.33 22.4 0.24 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -165.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.446 ' HD2' ' HA ' ' A' ' 82' ' ' LYS . 7.2 ptm180 -78.42 -21.95 48.47 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 118.215 -1.394 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 C--O 1.251 1.144 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.575 177.63 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 111.326 -0.709 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 55.1 m -97.35 -7.66 31.39 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 117.315 0.557 . . . . 0.0 111.315 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.4 ptm -72.33 157.8 36.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 30.9 m -78.27 78.45 4.75 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.487 0.66 . . . . 0.0 110.216 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -104.27 8.23 36.03 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.896 0.855 . . . . 0.0 108.783 177.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.41 ' HA ' ' OH ' ' A' ' 73' ' ' TYR . 96.0 m-85 -81.03 104.81 11.78 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.207 -1.361 . . . . 0.0 108.614 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -105.2 31.03 8.98 Favored Glycine 0 C--N 1.297 -1.627 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -70.08 -13.5 62.24 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -174.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.461 ' H ' ' CD ' ' B' ' 109' ' ' GLN . 10.4 mp0 -67.17 -44.19 80.35 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.5 m -63.26 -38.38 90.92 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.518 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.91 -45.22 75.0 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-O 121.13 0.49 . . . . 0.0 111.168 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -28.67 62.67 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.513 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.31 -48.37 82.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 109.251 175.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 45.8 tp -57.1 -50.0 74.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.423 177.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.64 -54.19 48.98 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.083 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.4 t -65.09 -28.18 69.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.668 0.27 . . . . 0.0 110.913 -176.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 51.5 m -73.42 -41.59 63.09 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.075 0.464 . . . . 0.0 110.389 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.414 ' HB3' ' NE2' ' A' ' 17' ' ' HIS . 23.3 m-20 -75.97 -58.74 3.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.979 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.581 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 15.8 t -77.88 -55.36 5.38 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -172.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 93.8 mt -74.28 -25.91 59.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -169.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -76.66 -19.0 58.24 Favored 'General case' 0 C--N 1.308 -1.217 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.819 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . 0.485 ' CG ' ' HA3' ' B' ' 126' ' ' GLY . 55.1 m80 -115.26 -63.19 1.49 Allowed 'General case' 0 C--O 1.243 0.746 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -175.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 36.6 t 71.67 114.63 0.05 Allowed 'General case' 0 C--O 1.257 1.454 0 C-N-CA 125.621 1.568 . . . . 0.0 110.978 -172.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.433 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . 20.3 t70 70.52 -70.58 0.15 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.422 1.489 . . . . 0.0 112.15 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -95.43 90.36 1.24 Allowed Glycine 0 N--CA 1.434 -1.498 0 N-CA-C 111.436 -0.665 . . . . 0.0 111.436 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.485 ' HA3' ' CG ' ' B' ' 122' ' ' HIS . . . 162.93 156.68 8.67 Favored Glycine 0 N--CA 1.431 -1.674 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.61 74.89 0.88 Allowed Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 12.8 t -79.19 -168.63 1.55 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 123.122 0.569 . . . . 0.0 110.295 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -80.43 60.42 4.54 Favored Glycine 0 C--O 1.238 0.347 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -86.47 111.47 3.63 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -173.99 147.05 9.08 Favored Glycine 0 N--CA 1.428 -1.854 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 63.2 m -150.75 106.87 3.44 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.153 0.501 . . . . 0.0 110.714 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 166.97 -177.36 41.69 Favored Glycine 0 N--CA 1.433 -1.502 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.88 -172.45 33.93 Favored Glycine 0 C--N 1.304 -1.235 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.149 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.37 -50.79 0.88 Allowed Glycine 0 C--N 1.299 -1.521 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.8 p -131.23 12.06 5.04 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.74 -0.73 . . . . 0.0 110.353 178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 7.4 mp -95.69 -56.76 2.57 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.826 -176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.551 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -64.61 -42.16 95.73 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.711 178.69 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.21 -37.68 69.98 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 123.865 0.728 . . . . 0.0 110.538 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -82.99 -35.07 26.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.362 0.601 . . . . 0.0 110.22 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.662 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 11.9 tpt -64.19 -27.33 68.99 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.652 1.181 . . . . 0.0 109.774 179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 39.3 mt-10 -47.77 -26.47 1.61 Allowed 'General case' 0 C--O 1.193 -1.9 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.7 m -59.41 -60.6 3.6 Favored 'General case' 0 C--O 1.272 2.251 0 CA-C-N 118.756 0.707 . . . . 0.0 111.503 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.606 HD11 ' SD ' ' B' ' 141' ' ' MET . 2.4 pp -73.63 -25.9 21.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 122.246 1.022 . . . . 0.0 110.711 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 7.3 mm -68.72 -33.71 61.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -66.6 -42.77 86.36 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 m -59.78 -26.96 66.14 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.421 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.55 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 22.8 mm-40 -80.64 -62.71 1.59 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.98 -35.2 74.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -169.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 16.4 tpt -71.87 -55.97 6.57 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 120.439 -0.504 . . . . 0.0 111.313 -175.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -146.78 110.34 4.88 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.239 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 178.399 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.445 0 CA-C-O 120.256 -0.191 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.402 HG22 ' OE2' ' A' ' 56' ' ' GLU . 34.0 m -89.33 171.31 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 117.108 0.454 . . . . 0.0 109.871 178.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -129.85 96.31 4.19 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.213 1.006 . . . . 0.0 111.103 179.227 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -91.02 138.15 31.82 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.95 -29.14 8.03 Favored Glycine 0 N--CA 1.478 1.443 0 N-CA-C 115.87 1.108 . . . . 0.0 115.87 -172.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -72.75 -6.08 42.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -62.11 -18.25 60.21 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.28 0.562 . . . . 0.0 111.534 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -90.15 0.2 57.29 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.468 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.5 m-70 -113.05 4.39 16.65 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.541 0.686 . . . . 0.0 110.454 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HD12 ' A' ' 14' ' ' LEU . 7.7 p -129.15 125.68 62.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.1 m -96.54 154.05 17.5 Favored 'General case' 0 C--N 1.285 -2.234 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.093 -175.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -40.62 66.4 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 123.185 0.594 . . . . 0.0 111.105 177.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.42 -33.89 74.46 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.545 HD12 HG23 ' A' ' 10' ' ' VAL . 2.8 tm? -74.4 -51.05 16.13 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -175.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HB2' ' OE2' ' A' ' 51' ' ' GLU . 8.1 ptm180 -63.21 -43.05 99.23 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.785 -1.098 . . . . 0.0 112.041 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.437 ' O ' ' HB ' ' A' ' 19' ' ' VAL . 35.6 t -67.8 -26.15 65.93 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.65 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.659 ' CD2' ' HA ' ' B' ' 119' ' ' SER . 20.6 t60 -71.95 -38.21 69.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.075 177.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.5 OUTLIER -64.45 -35.57 81.36 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.251 175.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 15' ' ' ARG . 98.1 t -56.06 -49.52 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-O 121.529 0.68 . . . . 0.0 109.654 175.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -57.37 -45.15 84.73 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.798 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HD3' ' CD2' ' B' ' 115' ' ' LEU . 20.2 mttp -67.51 -35.55 79.33 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.351 177.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 19' ' ' VAL . 82.3 mt -56.74 -43.92 81.2 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.629 0.372 . . . . 0.0 110.037 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.487 ' HA ' HG22 ' A' ' 26' ' ' ILE . 85.5 t -63.6 -48.38 87.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.321 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -63.49 -25.21 68.15 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.538 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -80.01 -46.27 16.91 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.292 176.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.487 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.5 tt -70.44 -35.78 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 109.997 -177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.44 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 53.5 t80 -121.82 99.28 44.6 Favored Pre-proline 0 N--CA 1.397 -3.078 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.512 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 43.1 Cg_endo -65.11 98.08 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.967 1.778 . . . . 0.0 108.603 171.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -71.2 132.9 85.85 Favored Pre-proline 0 N--CA 1.426 -1.673 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.321 -174.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -72.63 -37.15 4.25 Favored 'Trans proline' 0 C--O 1.217 -0.561 0 C-N-CA 122.524 2.149 . . . . 0.0 111.53 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -140.73 153.46 67.87 Favored Pre-proline 0 CA--C 1.494 -1.175 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.85 -15.54 49.57 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.338 2.025 . . . . 0.0 111.72 175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.47 -18.94 54.14 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.314 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.92 -6.11 53.29 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.603 0.716 . . . . 0.0 110.019 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 40' ' ' MET . 25.8 mt -90.76 -0.48 57.72 Favored 'General case' 0 C--O 1.21 -1.018 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.342 -179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -132.74 20.6 4.21 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.202 1.001 . . . . 0.0 109.213 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.594 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 16.5 t70 -88.5 170.22 11.08 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.407 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.594 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -62.6 -25.45 68.1 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 122.997 0.519 . . . . 0.0 112.029 -179.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 38.8 ttp180 -75.14 -19.14 60.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 109.723 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.574 ' HB3' ' O ' ' A' ' 37' ' ' ASP . 7.9 tpp -61.46 -46.56 89.52 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.792 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 12.3 pt-20 -58.85 -29.29 66.84 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 123.263 0.352 . . . . 0.0 110.922 -177.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.453 ' HB2' ' H ' ' B' ' 132' ' ' SER . 6.4 t30 -71.58 -51.74 21.82 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.68 0.752 . . . . 0.0 110.213 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.9 -45.75 84.59 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.103 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 7.0 p -73.26 -28.59 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.556 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.123 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.89 -49.74 76.63 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -56.51 -46.01 80.75 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.893 174.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.88 99.8 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 120.552 0.215 . . . . 0.0 111.187 -178.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.9 mttm -64.48 -48.1 76.47 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.134 0.574 . . . . 0.0 111.313 178.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' B' ' 148' ' ' GLU . 15.1 pttp -63.58 -40.63 97.44 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-O 121.282 0.563 . . . . 0.0 109.6 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.416 ' O ' ' HG2' ' A' ' 54' ' ' MET . 9.1 t -64.93 -47.86 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.619 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.9 tm-20 -54.16 -49.1 70.03 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 123.744 0.818 . . . . 0.0 109.766 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.22 -43.06 98.84 Favored Glycine 0 C--O 1.236 0.247 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.491 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.54 -52.42 65.48 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.97 0.508 . . . . 0.0 110.344 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.506 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 1.2 ptp -71.65 -27.92 63.4 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.572 0.952 . . . . 0.0 113.572 179.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -63.1 -49.48 74.29 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' OE2' HG22 ' A' ' 2' ' ' VAL . 31.6 mt-10 -78.38 -17.4 56.51 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.369 0.604 . . . . 0.0 111.864 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.506 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 24.7 m -79.97 -19.4 47.99 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.46 166.34 11.57 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -109.87 4.31 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.909 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -161.55 160.79 29.43 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.415 ' H ' ' CD ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -70.16 -36.15 74.49 Favored 'General case' 0 C--O 1.191 -2.017 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.584 -179.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.75 -31.59 70.74 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.55 -42.56 64.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.359 -0.213 . . . . 0.0 111.016 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -43.21 96.17 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -56.27 -48.95 75.55 Favored 'General case' 0 C--O 1.197 -1.668 0 C-N-CA 124.924 1.29 . . . . 0.0 108.857 173.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -59.37 -55.55 33.25 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 123.492 0.717 . . . . 0.0 111.09 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.462 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.8 pp -71.17 -29.89 65.76 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.314 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.455 ' HB2' ' SD ' ' A' ' 54' ' ' MET . 0.6 OUTLIER -71.66 -39.43 70.31 Favored 'General case' 0 C--N 1.344 0.329 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 176.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.547 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.28 -35.84 81.69 Favored 'General case' 0 C--O 1.202 -1.415 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.655 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' TYR . 10.4 mm-40 -67.42 -42.87 82.51 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.075 0.55 . . . . 0.0 111.668 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.437 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -71.1 -36.55 72.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.654 -179.089 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.667 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -70.49 -38.78 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.506 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 19.2 t80 -52.81 -54.3 36.15 Favored 'General case' 0 C--O 1.265 1.883 0 C-N-CA 124.972 1.309 . . . . 0.0 110.997 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -65.26 -38.4 90.19 Favored 'General case' 0 C--O 1.189 -2.081 0 O-C-N 123.823 0.702 . . . . 0.0 110.117 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.15 -40.79 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.465 0.478 . . . . 0.0 110.712 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 60.5 mt-30 -61.98 -54.95 34.59 Favored 'General case' 0 CA--C 1.496 -1.115 0 O-C-N 123.87 0.731 . . . . 0.0 110.596 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -73.21 -27.12 61.44 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.815 -177.111 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.3 tt0 -67.9 -43.57 78.98 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HA ' ' HG3' ' A' ' 82' ' ' LYS . 4.3 pp -69.57 -33.66 73.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.291 178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 41.5 mt-10 -63.89 -52.91 57.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.184 176.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.84 -38.8 92.43 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.671 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.563 ' HB2' ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -67.5 -28.72 68.08 Favored 'General case' 0 CA--C 1.505 -0.779 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.239 178.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.413 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 20.9 tpt180 -76.87 -35.14 57.66 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.843 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 6.5 ptp180 -99.7 -43.14 6.57 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 31.0 p -124.57 13.31 8.71 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -171.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.563 ' HD2' ' HB2' ' A' ' 82' ' ' LYS . 9.3 ptm180 -89.28 -28.28 20.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 116.985 -1.886 . . . . 0.0 110.564 -179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 C--O 1.245 0.841 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 176.351 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.191 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 23.0 t -101.5 16.67 24.93 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 24.3 mmt -86.63 81.16 8.34 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.594 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.3 t -78.04 -38.5 44.41 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 172.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 -112.85 143.08 44.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 73.3 t80 74.73 8.33 4.29 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 122.47 1.128 . . . . 0.0 109.639 -175.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -92.24 36.21 3.75 Favored Glycine 0 N--CA 1.44 -1.049 0 O-C-N 121.366 -0.834 . . . . 0.0 113.468 -175.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 36.3 p30 -77.36 -8.91 58.44 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-O 121.452 0.644 . . . . 0.0 111.68 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -50.95 -49.14 60.51 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 125.582 1.553 . . . . 0.0 112.456 177.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.403 HG23 HD22 ' B' ' 111' ' ' LEU . 8.7 t -75.37 -33.38 61.04 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-O 120.814 0.34 . . . . 0.0 110.329 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' B' ' 115' ' ' LEU . 4.2 mm? -64.35 -50.59 67.14 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.955 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -69.94 -33.77 72.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.739 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -62.33 -46.84 86.88 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.789 -0.764 . . . . 0.0 110.424 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 66.4 tp -57.9 -41.8 83.37 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.778 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.545 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 50.6 mt -61.94 -66.14 0.58 Allowed 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.229 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.3 m -52.54 -36.01 54.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.457 0.703 . . . . 0.0 112.24 -174.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 54.5 p -76.72 -55.31 5.61 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.975 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.86 -24.34 52.63 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -174.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.659 ' HA ' ' CD2' ' A' ' 17' ' ' HIS . 42.4 p -65.92 -55.29 17.64 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -76.98 -25.15 52.4 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -176.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.5 p -76.13 -51.33 12.42 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.005 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -79.32 -45.42 19.67 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.701 -178.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 22.9 m 63.91 -172.46 0.17 Allowed 'General case' 0 C--O 1.247 0.924 0 C-N-CA 123.689 0.795 . . . . 0.0 110.561 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 66.45 154.29 0.08 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 176.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -161.03 -85.47 0.06 OUTLIER Glycine 0 N--CA 1.428 -1.84 0 N-CA-C 107.896 -2.082 . . . . 0.0 107.896 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.66 -135.76 15.83 Favored Glycine 0 N--CA 1.434 -1.436 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 174.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 98.14 158.53 30.14 Favored Glycine 0 N--CA 1.432 -1.631 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.653 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 1.3 p -87.03 -160.96 0.63 Allowed 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 124.971 1.309 . . . . 0.0 110.739 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -159.77 112.61 0.53 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.072 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -163.12 -152.38 6.8 Favored Glycine 0 C--N 1.319 -0.37 0 C-N-CA 121.071 -0.585 . . . . 0.0 111.919 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -144.0 114.7 0.83 Allowed Glycine 0 C--O 1.24 0.519 0 N-CA-C 111.743 -0.543 . . . . 0.0 111.743 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . 0.453 ' H ' ' HB2' ' A' ' 42' ' ' ASN . 47.6 m -162.51 105.11 1.1 Allowed 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.36 1.064 . . . . 0.0 108.682 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -98.77 174.89 28.4 Favored Glycine 0 C--O 1.244 0.769 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.226 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 116.69 68.61 0.4 Allowed Glycine 0 N--CA 1.435 -1.4 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -77.52 -125.63 0.31 Allowed Glycine 0 N--CA 1.446 -0.696 0 O-C-N 123.557 0.21 . . . . 0.0 113.575 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 43.0 m -156.56 -46.22 0.07 Allowed 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 24.1 tp -105.96 -39.67 5.93 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.35 0.595 . . . . 0.0 111.319 -173.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -54.4 -52.62 61.13 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 125.693 1.597 . . . . 0.0 113.088 -176.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 52.2 m 54.31 -95.32 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -80.8 -9.86 59.78 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.265 -0.897 . . . . 0.0 111.236 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.647 ' O ' HG12 ' B' ' 145' ' ' ILE . 16.0 tpt -77.45 -27.27 52.08 Favored 'General case' 0 C--O 1.204 -1.313 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 171.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' B' ' 138' ' ' GLU . 7.1 tt0 -71.59 -25.99 62.41 Favored 'General case' 0 C--O 1.193 -1.88 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.678 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.5 m -55.47 -51.83 65.67 Favored 'General case' 0 C--O 1.266 1.971 0 CA-C-O 121.134 0.492 . . . . 0.0 110.329 175.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.531 HD11 ' SD ' ' B' ' 141' ' ' MET . 43.3 pt -67.0 -32.87 59.96 Favored 'Isoleucine or valine' 0 C--N 1.342 0.249 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.647 HG12 ' O ' ' B' ' 141' ' ' MET . 22.4 mm -65.68 -33.47 63.86 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.82 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.198 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.406 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 58.0 ttp180 -65.27 -43.02 92.58 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 49.3 m -62.41 -37.45 85.85 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.767 175.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.628 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 12.7 mm-40 -72.82 -43.85 62.18 Favored 'General case' 0 C--O 1.199 -1.575 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 178.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.406 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 4.2 pp -68.13 -33.92 75.38 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.362 0.528 . . . . 0.0 110.673 -177.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 21.7 mmt -77.68 -22.48 50.49 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 121.046 0.45 . . . . 0.0 109.867 174.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.91 1.16 3.93 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.638 1.575 . . . . 0.0 111.684 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.8 0 C-N-CA 124.524 1.13 . . . . 0.0 108.178 179.474 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.912 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 m -72.86 142.52 14.99 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.551 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -90.63 97.64 11.3 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 122.273 1.035 . . . . 0.0 109.945 -175.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 mttp -86.58 124.64 33.1 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 113.652 -1.613 . . . . 0.0 107.187 -174.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -51.64 -23.35 9.86 Favored Glycine 0 N--CA 1.478 1.459 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.1 p-90 -70.48 -12.16 61.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.49 ' CD2' ' HG3' ' A' ' 8' ' ' GLU . 0.3 OUTLIER -64.77 -19.47 65.83 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.049 0.452 . . . . 0.0 111.859 -177.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HG3' ' CD2' ' A' ' 7' ' ' HIS . 46.2 mt-10 -90.23 -8.54 50.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.438 0.637 . . . . 0.0 110.117 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -96.89 10.74 38.17 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.89 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.494 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 5.8 p -138.5 115.01 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.554 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.0 m -91.96 154.45 18.81 Favored 'General case' 0 C--N 1.289 -2.039 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.82 -41.62 45.29 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 123.527 0.731 . . . . 0.0 111.047 177.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.52 -41.15 72.73 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.143 0.577 . . . . 0.0 111.535 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.419 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -74.09 -50.47 19.4 Favored 'General case' 0 CA--C 1.499 -1.002 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -173.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 19' ' ' VAL . 9.1 ptm180 -65.53 -38.41 89.57 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.026 -177.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -74.01 -22.67 59.5 Favored 'General case' 0 N--CA 1.423 -1.801 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.452 ' O ' ' HB3' ' A' ' 20' ' ' HIS . 26.0 t60 -74.15 -35.26 64.05 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 174.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.629 HD23 HD21 ' A' ' 68' ' ' LEU . 3.1 mp -63.9 -38.27 90.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.3 t -60.89 -46.57 96.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.465 0.706 . . . . 0.0 109.421 172.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.452 ' HB3' ' O ' ' A' ' 17' ' ' HIS . 23.5 t-80 -53.72 -48.48 69.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.438 176.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -65.21 -39.32 92.64 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.906 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 19' ' ' VAL . 49.9 mt -54.65 -48.05 72.79 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.216 0.322 . . . . 0.0 110.417 174.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.9 t -59.25 -48.99 85.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.018 0 O-C-N 123.842 0.714 . . . . 0.0 111.481 174.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.476 ' HB3' ' HB3' ' B' ' 132' ' ' SER . 60.1 mt-30 -71.3 -20.58 62.18 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -176.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.499 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.36 -46.2 15.02 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.05 176.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.571 HD11 ' CG2' ' B' ' 145' ' ' ILE . 1.7 tt -70.47 -35.15 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 CA-C-O 122.269 1.033 . . . . 0.0 108.724 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' HA ' ' HB3' ' B' ' 138' ' ' GLU . 4.9 m-85 -127.87 89.14 51.42 Favored Pre-proline 0 N--CA 1.398 -3.035 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.946 -178.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.41 84.16 0.37 Allowed 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.954 1.769 . . . . 0.0 107.663 171.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 t -52.14 134.58 40.34 Favored Pre-proline 0 N--CA 1.424 -1.735 0 CA-C-N 113.965 -1.47 . . . . 0.0 113.396 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.49 -22.35 21.42 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.203 2.602 . . . . 0.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -157.38 141.57 11.69 Favored Pre-proline 0 CA--C 1.511 -0.555 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -178.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -56.92 -18.09 26.49 Favored 'Trans proline' 0 CA--C 1.549 1.262 0 C-N-CA 122.921 2.414 . . . . 0.0 114.346 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.77 -15.17 57.98 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 121.493 -0.754 . . . . 0.0 112.06 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.39 -9.6 58.86 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.879 0.847 . . . . 0.0 109.463 176.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.8 mt -89.4 1.56 55.66 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 114.704 -1.134 . . . . 0.0 110.494 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -134.89 12.6 3.65 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.389 1.09 . . . . 0.0 109.497 176.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.599 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 31.7 t70 -87.36 177.65 7.06 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.985 -1.461 . . . . 0.0 110.001 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.599 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.87 -18.08 62.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.435 0.636 . . . . 0.0 110.668 178.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -74.37 -28.02 60.92 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -64.48 -43.5 93.96 Favored 'General case' 0 C--O 1.193 -1.913 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.479 -176.394 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HA ' HG22 ' A' ' 44' ' ' VAL . 7.1 pt-20 -61.58 -29.6 70.13 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.088 0.47 . . . . 0.0 110.966 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -74.61 -44.2 51.82 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.698 176.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.74 -42.38 81.95 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.711 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.483 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 28.4 m -69.83 -35.77 66.54 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.124 0 CA-C-O 119.08 -0.486 . . . . 0.0 110.125 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.97 85.18 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.41 0.624 . . . . 0.0 109.691 176.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.524 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.69 -47.42 86.36 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.826 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.4 93.97 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.017 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 67.6 mttm -66.3 -44.33 83.77 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.292 0.637 . . . . 0.0 111.443 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.9 pttp -63.46 -41.11 98.62 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.599 0.714 . . . . 0.0 109.602 -179.048 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.414 HG11 ' HE2' ' A' ' 71' ' ' LYS . 38.0 t -66.29 -51.98 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.022 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.409 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.4 tm-20 -55.76 -47.79 76.4 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.271 1.029 . . . . 0.0 109.846 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.44 -38.62 96.06 Favored Glycine 0 N--CA 1.443 -0.857 0 O-C-N 123.665 0.603 . . . . 0.0 112.717 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -62.03 -51.95 65.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.452 0.644 . . . . 0.0 110.883 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . 2.2 ptp -72.15 -27.29 62.5 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.929 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -62.54 -53.74 50.2 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 174.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.61 -26.45 65.37 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.863 -179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 t -78.87 -22.92 45.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -86.27 163.34 17.78 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.753 0.787 . . . . 0.0 112.847 -176.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -108.12 4.5 24.99 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.112 -178.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.422 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 9.8 p -167.32 154.9 8.97 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.693 0.797 . . . . 0.0 108.949 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.494 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.17 -31.8 66.26 Favored 'General case' 0 C--O 1.194 -1.866 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.616 -175.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.422 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 6.1 p-10 -72.23 -28.54 63.23 Favored 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.537 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 8.8 tp10 -73.63 -44.21 57.52 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 173.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -41.22 98.64 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-O 120.969 0.414 . . . . 0.0 109.94 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.47 ' OH ' ' HB ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -55.85 -48.52 75.38 Favored 'General case' 0 C--O 1.209 -1.075 0 C-N-CA 124.349 1.059 . . . . 0.0 108.293 171.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.3 t-80 -61.82 -57.91 10.0 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.732 1.213 . . . . 0.0 111.859 -175.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.601 ' CD1' ' HB2' ' A' ' 54' ' ' MET . 1.5 pp -66.41 -30.26 70.59 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.629 HD21 HD23 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -76.11 -34.22 59.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.438 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.606 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -65.11 -31.41 72.6 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 176.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 24.8 mm-40 -65.76 -50.14 65.82 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.954 0.883 . . . . 0.0 109.392 174.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -62.26 -45.24 94.16 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.101 -179.648 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.626 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.4 tt -68.79 -34.84 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.677 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -176.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' A' ' 70' ' ' GLU . 34.0 t80 -55.63 -54.45 43.97 Favored 'General case' 0 C--O 1.271 2.223 0 C-N-CA 124.515 1.126 . . . . 0.0 110.471 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.3 ptpt -66.83 -32.45 73.73 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.83 -176.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.38 -41.67 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 O-C-N 123.152 0.283 . . . . 0.0 110.5 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 58.0 mt-30 -62.73 -51.54 66.76 Favored 'General case' 0 CA--C 1.478 -1.805 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.604 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 0.1 OUTLIER -70.89 -26.81 63.4 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 115.14 -0.936 . . . . 0.0 113.409 -178.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.17 -52.59 64.67 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.3 pp -64.33 -39.46 93.94 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.968 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.618 ' O ' ' HB3' ' A' ' 84' ' ' ARG . 45.6 mt-10 -59.53 -53.25 60.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 123.555 0.534 . . . . 0.0 111.345 177.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 77' ' ' LYS 0.266 13.1 pt-20 -76.69 -35.51 57.85 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -177.091 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.74 -37.5 67.69 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 118.976 -1.089 . . . . 0.0 111.8 -178.334 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.531 ' HG3' ' HA ' ' B' ' 137' ' ' LEU . 1.1 tmt_? -78.72 -46.28 19.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.788 0.327 . . . . 0.0 110.522 178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.618 ' HB3' ' O ' ' A' ' 80' ' ' GLU . 44.7 ttt180 -96.3 -59.19 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -173.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 56.7 m -151.38 89.83 1.53 Allowed 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 115.877 1.806 . . . . 0.0 115.877 -170.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 5.9 ptp180 -138.33 -1.5 1.91 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.551 0.691 . . . . 0.0 109.343 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--O 1.253 1.275 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.289 -177.759 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.14 0 N-CA-C 110.684 -0.967 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -68.63 107.38 2.95 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.171 0.51 . . . . 0.0 110.892 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 15.6 tpt 64.0 92.98 0.06 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.7 1.6 . . . . 0.0 112.365 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 33.2 p -87.03 134.26 33.51 Favored 'General case' 0 N--CA 1.417 -2.109 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -87.32 16.71 5.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-O 121.427 0.632 . . . . 0.0 110.782 -176.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -150.26 173.23 14.2 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 125.767 1.627 . . . . 0.0 108.174 173.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.61 -44.9 1.19 Allowed Glycine 0 C--N 1.3 -1.433 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 64.4 12.73 7.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.504 1.522 . . . . 0.0 114.015 169.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -62.02 -49.32 76.51 Favored 'General case' 0 CA--C 1.497 -1.058 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -175.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' B' ' 114' ' ' LEU . 17.6 m -56.02 -44.76 79.03 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.624 0.578 . . . . 0.0 110.782 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.29 -48.96 60.15 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.39 -178.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -66.08 -32.43 73.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.694 -177.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.78 -47.28 84.19 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.95 0.781 . . . . 0.0 109.379 175.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 110' ' ' THR . 94.8 mt -56.33 -41.56 76.27 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.778 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.83 -64.9 0.69 Allowed 'General case' 0 C--N 1.347 0.465 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.157 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.47 ' HB ' ' OH ' ' A' ' 65' ' ' TYR . 8.9 t -62.48 -33.42 74.81 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -174.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 27.2 p -70.77 -50.89 31.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -76.05 -46.49 28.91 Favored 'General case' 0 CA--C 1.51 -0.593 0 C-N-CA 119.136 -1.026 . . . . 0.0 112.308 -177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 9.7 m -59.55 -50.89 72.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -172.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.78 -23.14 58.47 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.7 t -76.57 -33.11 58.5 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -62.67 -47.02 85.5 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.93 179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 17.5 m -63.37 -33.7 76.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.353 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -134.53 86.05 2.23 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-O 120.769 0.318 . . . . 0.0 110.528 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 134.86 -57.97 0.69 Allowed Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 108.56 -101.5 1.57 Allowed Glycine 0 N--CA 1.426 -1.992 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.114 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -159.1 51.14 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.6 p -129.6 97.8 4.64 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -78.97 57.15 4.33 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-N 116.203 -0.453 . . . . 0.0 112.994 -177.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -95.38 57.19 1.69 Allowed Glycine 0 N--CA 1.436 -1.324 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -178.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -87.97 44.5 3.23 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 112.319 -0.312 . . . . 0.0 112.319 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . 0.476 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 29.3 t -168.81 162.09 11.32 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 164.22 -179.68 38.94 Favored Glycine 0 N--CA 1.426 -1.988 0 N-CA-C 107.434 -2.266 . . . . 0.0 107.434 -178.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 156.51 -89.71 0.12 Allowed Glycine 0 C--N 1.298 -1.554 0 C-N-CA 119.327 -1.416 . . . . 0.0 112.583 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 148.3 -127.79 2.66 Favored Glycine 0 N--CA 1.425 -2.097 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.668 -177.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 17.0 p -72.99 47.93 0.2 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -170.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.531 ' HA ' ' HG3' ' A' ' 83' ' ' ARG . 5.6 mp -105.15 -26.85 11.91 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 121.428 -0.795 . . . . 0.0 110.258 175.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.1 -47.79 60.34 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.601 -1.181 . . . . 0.0 113.922 -175.202 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 78.0 m -61.9 -21.02 64.37 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.83 -32.67 25.16 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 121.238 0.542 . . . . 0.0 109.992 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.471 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 10.4 ttm -81.3 -18.58 45.33 Favored 'General case' 0 C--O 1.257 1.471 0 C-N-CA 123.358 0.663 . . . . 0.0 111.857 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.574 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 32.8 mt-10 -48.89 -27.5 3.12 Favored 'General case' 0 C--O 1.191 -1.992 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -178.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 1.6 m -57.62 -59.61 4.93 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 119.415 1.007 . . . . 0.0 109.881 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . 0.413 HD11 ' HG3' ' B' ' 141' ' ' MET . 2.7 pp -71.06 -24.24 24.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.748 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.574 ' HB ' ' HA ' ' B' ' 142' ' ' GLU . 9.4 mm -72.0 -45.65 62.82 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.389 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.755 175.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.479 ' HA ' ' HG ' ' B' ' 149' ' ' LEU . 96.8 mtt180 -63.69 -35.9 82.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 117.833 0.288 . . . . 0.0 110.902 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.1 m -62.12 -50.66 71.02 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.874 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -62.73 -40.7 98.03 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.474 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' B' ' 146' ' ' ARG . 3.5 pp -75.67 -22.75 56.44 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.64 -0.663 . . . . 0.0 112.492 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 41.3 tpp -69.62 -26.18 64.31 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 173.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 19.5 t70 71.81 17.44 5.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.723 1.609 . . . . 0.0 111.471 172.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.323 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.686 179.754 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.135 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.418 HG13 ' HE3' ' A' ' 4' ' ' LYS . 39.0 t 62.5 84.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 0.0 111.482 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.36 22.16 5.61 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.263 177.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.418 ' HE3' HG13 ' A' ' 2' ' ' VAL . 14.8 pttp -55.88 102.79 0.08 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.104 172.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.77 -24.63 4.31 Favored Glycine 0 N--CA 1.47 0.914 0 C-N-CA 125.603 1.573 . . . . 0.0 116.964 -168.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.414 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 68.5 p-90 -62.59 -16.87 58.56 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -12.59 54.24 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.987 0.423 . . . . 0.0 112.072 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.78 -26.01 34.81 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 109.818 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -90.87 2.75 55.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.687 -176.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.462 HG23 HD12 ' A' ' 14' ' ' LEU . 7.6 p -135.6 110.52 11.42 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-O 121.535 0.683 . . . . 0.0 109.501 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.43 171.12 8.9 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.991 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.47 -43.57 68.26 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 124.298 0.999 . . . . 0.0 110.807 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -52.53 -44.23 65.62 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.599 ' O ' HD22 ' A' ' 18' ' ' LEU . 3.4 tm? -75.72 -47.54 25.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -172.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' HG23 ' A' ' 19' ' ' VAL . 10.0 ptm180 -65.68 -44.72 85.36 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.486 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.5 t -68.93 -23.12 64.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 121.261 0.553 . . . . 0.0 109.545 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.669 ' CD2' ' HB2' ' B' ' 119' ' ' SER . 34.3 t60 -68.38 -44.75 74.48 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 174.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.599 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.7 OUTLIER -63.12 -37.66 88.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 119.217 -0.993 . . . . 0.0 109.725 176.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 15' ' ' ARG . 84.6 t -54.27 -46.74 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.586 0.554 . . . . 0.0 109.781 175.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.522 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 53.9 t-80 -61.05 -41.59 96.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.048 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.49 ' HE2' ' OE1' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -73.26 -31.34 64.03 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 179.167 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 19' ' ' VAL . 88.0 mt -56.9 -42.51 80.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 173.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 24.0 t -59.36 -53.53 46.91 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.848 172.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.49 ' OE1' ' HE2' ' A' ' 21' ' ' LYS . 46.3 mt-30 -61.76 -26.34 68.02 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -81.65 -46.99 13.56 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.562 177.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.651 HD11 HG23 ' B' ' 145' ' ' ILE . 4.7 tt -71.86 -29.65 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 122.111 0.957 . . . . 0.0 109.943 -177.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.461 ' CD1' ' HG2' ' B' ' 138' ' ' GLU . 79.7 t80 -130.23 83.43 63.02 Favored Pre-proline 0 N--CA 1.4 -2.954 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.306 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.48 84.03 0.13 Allowed 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.58 2.186 . . . . 0.0 107.959 170.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.0 t -58.35 142.62 81.41 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.401 -171.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.11 -30.93 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.345 2.03 . . . . 0.0 110.57 174.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -146.12 139.77 14.87 Favored Pre-proline 0 CA--C 1.506 -0.75 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 -175.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -54.46 -22.13 26.41 Favored 'Trans proline' 0 CA--C 1.563 1.935 0 C-N-CA 122.668 2.245 . . . . 0.0 114.168 175.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.68 -10.0 59.72 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 121.199 -0.938 . . . . 0.0 112.105 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -80.39 -7.94 59.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 109.694 176.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 40' ' ' MET . 35.6 mt -86.93 2.73 48.35 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.225 -178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -133.12 16.12 4.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.544 0.688 . . . . 0.0 109.467 178.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 40' ' ' MET . 24.3 t70 -81.48 176.98 9.23 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.037 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.532 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -70.67 -22.78 62.44 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.918 -0.488 . . . . 0.0 111.725 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -73.1 -22.03 60.64 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.624 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 8.2 tpp -61.3 -45.61 93.74 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.838 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -59.62 -30.72 68.9 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 119.766 -0.773 . . . . 0.0 111.155 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -72.34 -46.05 57.24 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.068 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.13 -42.11 76.46 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.478 -178.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.624 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.7 p -73.26 -30.84 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.573 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.68 91.97 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.544 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -59.67 -48.36 81.96 Favored 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.272 175.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.32 97.17 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 120.617 0.246 . . . . 0.0 110.964 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -65.11 -45.4 85.28 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.5 pttp -62.47 -40.98 98.41 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.419 ' O ' ' HG2' ' A' ' 54' ' ' MET . 25.0 t -65.07 -52.78 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.991 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.214 179.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 15.1 tm-20 -57.65 -48.28 79.93 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 123.906 0.883 . . . . 0.0 109.652 -178.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.62 -40.52 94.78 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.963 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.28 -54.28 47.63 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.401 0.619 . . . . 0.0 110.5 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 1.5 ptp -68.75 -30.05 68.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -66.84 -38.41 86.33 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.831 0.824 . . . . 0.0 108.936 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -82.48 -25.62 33.36 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.868 -1.145 . . . . 0.0 112.648 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -82.93 -26.65 31.22 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 120.907 0.384 . . . . 0.0 111.898 -178.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.72 155.76 25.36 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -175.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -102.33 -0.29 32.99 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.097 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.4 p -156.9 159.3 38.01 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.11 -27.61 62.75 Favored 'General case' 0 C--O 1.17 -3.12 0 C-N-CA 118.288 -1.365 . . . . 0.0 109.504 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.85 -40.35 87.88 Favored 'General case' 0 C--O 1.209 -1.037 0 O-C-N 123.625 0.578 . . . . 0.0 109.501 178.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.8 -45.52 85.91 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.82 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -47.55 82.61 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.441 ' HD1' ' N ' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -51.2 -48.63 61.94 Favored 'General case' 0 C--O 1.21 -0.988 0 C-N-CA 125.892 1.677 . . . . 0.0 109.756 174.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 28.7 t-80 -74.15 -49.39 23.9 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.676 -169.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -67.73 -29.46 68.7 Favored 'General case' 0 C--O 1.249 1.065 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.502 -178.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.499 HD21 ' HG ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -73.22 -40.03 65.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.171 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.55 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -61.1 -34.5 75.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 123.381 0.425 . . . . 0.0 109.93 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 7.4 mm-40 -63.68 -46.28 86.28 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.362 0.665 . . . . 0.0 111.005 175.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -72.32 -36.97 69.02 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.345 -0.942 . . . . 0.0 112.108 -178.163 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.604 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -67.03 -38.75 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.516 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 4.9 t80 -53.96 -54.51 37.94 Favored 'General case' 0 C--O 1.254 1.329 0 C-N-CA 124.824 1.25 . . . . 0.0 111.271 175.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.9 ptpt -66.04 -33.84 76.72 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.461 -175.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.71 -44.31 96.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 O-C-N 123.439 0.462 . . . . 0.0 111.103 177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 48.2 mt-30 -61.27 -50.75 71.74 Favored 'General case' 0 CA--C 1.49 -1.341 0 CA-C-O 121.504 0.668 . . . . 0.0 110.946 -176.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.615 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 ptpt -73.62 -29.17 62.2 Favored 'General case' 0 N--CA 1.395 -3.221 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.961 -177.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 28.4 tt0 -62.61 -52.62 62.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.843 ' HB3' ' SD ' ' B' ' 141' ' ' MET . 3.9 pp -60.61 -45.45 93.96 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 123.818 0.699 . . . . 0.0 110.813 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 84' ' ' ARG . 7.8 tp10 -59.55 -53.72 54.83 Favored 'General case' 0 N--CA 1.401 -2.923 0 O-C-N 123.898 0.749 . . . . 0.0 111.29 -178.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.1 pt-20 -71.92 -34.27 68.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 119.769 -0.772 . . . . 0.0 113.043 -176.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.477 ' NZ ' ' HB2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -75.5 -41.04 56.3 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.482 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.09 -41.66 61.34 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -176.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 80' ' ' GLU . 13.1 ttm180 -67.62 -38.12 83.46 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 175.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 54.7 m 84.12 84.69 0.03 OUTLIER 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 113.59 -1.641 . . . . 0.0 112.642 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -71.2 -27.04 63.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 78.3 mt . . . . . 0 C--O 1.245 0.824 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.485 -178.628 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.764 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 22.9 t -91.83 114.15 26.61 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.3 mmt -80.96 81.96 7.06 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.138 0.494 . . . . 0.0 110.28 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.0 t -154.62 148.15 25.2 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -137.58 176.28 8.84 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -118.49 176.34 5.3 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 174.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.97 -48.3 4.03 Favored Glycine 0 C--N 1.312 -0.776 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.776 -176.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.469 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 41.5 p-10 -71.33 -8.59 54.72 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 125.245 1.418 . . . . 0.0 110.42 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -58.75 -51.81 68.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.795 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 47.4 m -58.75 -39.0 79.67 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.846 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.49 -54.9 21.62 Favored 'General case' 0 C--O 1.247 0.957 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.949 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 108' ' ' ASN . 0.0 OUTLIER -73.07 -25.14 60.8 Favored 'General case' 0 C--O 1.247 0.971 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.574 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -60.1 -51.27 70.34 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.88 -45.61 86.11 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.935 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.12 -61.51 2.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.471 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.5 m -60.21 -40.61 90.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.424 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' B' ' 121' ' ' SER . 60.7 p -77.39 -35.12 54.64 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.039 -174.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.1 -49.86 32.87 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.624 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.669 ' HB2' ' CD2' ' A' ' 17' ' ' HIS . 37.9 t -70.39 -55.02 10.1 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -177.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.61 -46.99 13.61 Favored 'General case' 0 N--CA 1.426 -1.645 0 C-N-CA 120.263 -0.575 . . . . 0.0 111.628 -172.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.562 ' HB3' ' O ' ' B' ' 117' ' ' SER . 22.6 t -76.78 -41.98 42.55 Favored 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -176.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -89.77 -72.82 0.54 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 118.357 -1.337 . . . . 0.0 111.689 -177.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 75.5 m 171.77 -165.53 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.267 1.827 . . . . 0.0 106.122 -173.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.16 75.19 5.71 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.039 0.923 . . . . 0.0 109.75 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 99.92 110.79 3.21 Favored Glycine 0 N--CA 1.432 -1.592 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -57.19 155.72 16.38 Favored Glycine 0 C--O 1.246 0.886 0 CA-C-N 116.635 0.217 . . . . 0.0 113.613 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -64.91 -38.93 96.12 Favored Glycine 0 C--O 1.225 -0.462 0 N-CA-C 114.158 0.423 . . . . 0.0 114.158 -176.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 13.2 m -76.03 -12.35 60.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.506 0.67 . . . . 0.0 110.576 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 135.78 104.72 0.77 Allowed Glycine 0 N--CA 1.418 -2.542 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -76.06 68.72 2.27 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 127.39 -167.73 19.68 Favored Glycine 0 N--CA 1.422 -2.245 0 N-CA-C 109.706 -1.358 . . . . 0.0 109.706 -176.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 13.3 t -143.05 146.76 34.12 Favored 'General case' 0 N--CA 1.426 -1.659 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -104.65 -144.81 13.35 Favored Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.93 -70.17 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.286 -0.959 . . . . 0.0 112.057 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 142.06 -113.91 0.85 Allowed Glycine 0 N--CA 1.424 -2.106 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.714 -177.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.9 m -92.59 31.09 1.4 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.74 -16.94 49.5 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.692 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.461 ' HG2' ' CD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.63 -24.6 49.51 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.555 0.693 . . . . 0.0 111.219 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 43.3 t -53.73 144.43 18.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.873 174.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 77.21 -33.78 0.2 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.215 1.006 . . . . 0.0 112.953 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.843 ' SD ' ' HB3' ' A' ' 79' ' ' LEU . 15.3 ttt -80.88 -27.02 36.46 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.602 ' HA ' ' HB ' ' B' ' 145' ' ' ILE . 36.6 mt-10 -48.57 -27.99 3.14 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -178.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.0 p -56.93 -59.7 4.66 Favored 'General case' 0 C--O 1.262 1.749 0 CA-C-O 121.671 0.748 . . . . 0.0 111.485 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.19 -24.3 24.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.406 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.651 HG23 HD11 ' A' ' 26' ' ' ILE . 14.8 mm -63.43 -46.45 95.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.79 173.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -59.85 -42.61 94.03 Favored 'General case' 0 C--N 1.314 -0.95 0 O-C-N 123.994 0.809 . . . . 0.0 109.19 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 21.5 m -66.33 -34.07 77.14 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.762 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -47.33 22.99 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.482 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 4.1 pp -66.94 -25.25 66.26 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 50.5 tpp -58.32 -45.66 87.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 175.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.6 t70 67.84 -57.13 0.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 112.851 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.294 -1.82 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.956 . . . . . . . . 0 0 . 1 stop_ save_