data_2juj_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 2juj _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.515 ' O ' HD12 ' A' ' 7' ' ' LEU . 1.3 tm? . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.8 t -66.31 -32.55 74.02 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.088 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.1 m -63.51 -29.78 71.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.02 173.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 65.4 mm-40 -61.31 -44.89 96.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 176.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.619 HD13 HD13 ' A' ' 28' ' ' LEU . 53.6 mt -54.76 -49.9 65.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.967 172.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.615 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 23.3 mm-40 -56.91 -28.7 62.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.395 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.496 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 2.8 t-20 -62.33 -51.25 68.37 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.419 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.653 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.72 -24.08 31.36 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.246 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.615 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 25.6 mmm -54.35 -45.63 72.79 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.328 172.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 t -61.92 -21.57 64.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.331 -0.849 . . . . 0.0 110.818 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -82.79 -12.52 57.43 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.705 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 115.54 -10.63 19.21 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.794 176.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.733 ' HB3' HD13 ' A' ' 42' ' ' LEU . 38.4 m-85 -55.07 153.04 6.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.531 . . . . 0.0 112.047 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.5 m -96.4 133.02 41.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.997 -171.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.589 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 42.0 p90 -64.12 -26.07 68.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.51 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.457 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 12.6 pt20 -60.39 -48.28 82.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.253 0.549 . . . . 0.0 110.347 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.555 ' HB3' HG13 ' A' ' 46' ' ' VAL . 7.1 m-20 -80.27 -25.35 39.51 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.495 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.589 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 46.6 mt -60.19 -50.2 81.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.517 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.62 -34.91 78.0 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.726 ' O ' HG21 ' A' ' 29' ' ' VAL . 23.7 ttpt -61.01 -46.41 90.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.155 176.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.544 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -58.17 -39.54 79.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.899 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.4 mt -64.12 -36.86 85.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.896 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.726 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.3 m -68.94 -31.25 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.191 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.692 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -87.16 -32.12 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -86.88 8.73 21.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.944 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.71 54.09 2.5 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.495 0.664 . . . . 0.0 110.68 -174.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 46.8 45.98 15.07 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.663 -174.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 0.6 OUTLIER -77.85 163.49 26.02 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 175.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.5 tt -73.32 -71.9 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.731 ' H ' HG22 ' A' ' 35' ' ' ILE . 50.0 mt-10 -78.1 -35.4 49.3 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.57 -175.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.472 ' HB3' ' HB2' ' A' ' 34' ' ' ASN . 31.6 ttm -59.74 -34.5 73.03 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.196 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.19 -52.45 14.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.308 . . . . 0.0 111.657 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.518 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 17.9 ptpt -62.42 -28.8 70.04 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.905 0.384 . . . . 0.0 110.768 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.95 -38.84 66.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.849 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.692 HG13 HD13 ' A' ' 30' ' ' ILE . 12.4 mm -65.98 -38.6 82.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.194 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.733 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.97 -44.85 94.19 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.276 -0.57 . . . . 0.0 109.491 174.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -45.34 81.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.789 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.09 -39.21 66.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.352 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -101.27 -84.49 0.44 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -170.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.56 HG11 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.09 148.45 10.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.905 -171.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--N 1.322 -0.627 0 CA-C-O 120.998 0.428 . . . . 0.0 111.164 -178.297 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.552 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.8 tm? . . . . . 0 C--O 1.223 -0.323 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 43.8 t -60.01 -30.72 69.33 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.969 174.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -76.83 -31.52 56.95 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.456 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.478 ' HB2' HG13 ' A' ' 35' ' ' ILE . 0.5 OUTLIER -65.36 -38.94 91.58 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.608 HD13 HD13 ' A' ' 28' ' ' LEU . 54.8 mt -57.58 -49.86 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.174 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 48.6 mt-10 -58.98 -26.08 64.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.704 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.408 ' C ' HD21 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -64.89 -49.11 71.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.974 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.651 HD12 ' HZ1' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -82.73 -23.67 33.92 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.23 177.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 26.0 mmm -54.3 -42.52 70.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.8 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -64.91 -12.49 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.63 HE21 ' HA ' ' A' ' 14' ' ' LEU . 49.3 mt-30 -77.63 -15.11 59.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.048 0.452 . . . . 0.0 110.198 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.01 2.2 30.09 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.083 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -62.61 165.64 6.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.018 0.437 . . . . 0.0 111.227 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m -111.09 132.1 54.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.702 -173.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.7 p90 -63.73 -23.66 67.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.597 -172.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.474 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.6 pt20 -59.9 -53.75 54.22 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.955 0.407 . . . . 0.0 111.056 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.474 ' H ' ' HG3' ' A' ' 22' ' ' GLN . 5.3 m-20 -79.56 -25.13 41.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.714 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.72 HG13 HD11 ' A' ' 42' ' ' LEU . 38.9 mt -59.64 -49.28 84.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 109.897 171.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.689 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.7 tt0 -63.86 -35.58 81.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.696 ' O ' HG21 ' A' ' 29' ' ' VAL . 32.8 ttmt -58.76 -48.74 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.289 175.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.432 ' O ' HG22 ' A' ' 30' ' ' ILE . . . -55.64 -40.96 72.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.119 177.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.9 mt -63.35 -38.92 93.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.24 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.696 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.88 -30.88 49.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.256 -175.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.587 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -29.11 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.499 0.666 . . . . 0.0 109.396 177.348 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.638 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -89.82 10.5 23.36 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.349 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 44.82 45.02 8.2 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.525 0.678 . . . . 0.0 110.295 -174.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.58 40.51 15.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.998 1.319 . . . . 0.0 112.601 -173.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 9.1 m-20 -76.93 130.68 37.86 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.735 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.631 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.1 tt -57.02 -53.69 39.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.199 1.0 . . . . 0.0 110.195 177.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.631 ' H ' HG22 ' A' ' 35' ' ' ILE . 9.8 pt-20 -68.28 -44.92 74.45 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.939 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.638 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 15.5 tpt -73.26 -32.95 65.0 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.275 -172.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 34' ' ' ASN . . . -67.51 -52.93 33.25 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.651 ' HZ1' HD12 ' A' ' 14' ' ' LEU . 2.2 ptpm? -64.02 -29.33 70.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.788 0.328 . . . . 0.0 110.432 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.494 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 41.1 m-20 -70.19 -36.87 74.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.281 175.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.587 HG13 HD13 ' A' ' 30' ' ' ILE . 14.8 mm -67.82 -38.87 80.9 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.552 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.72 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -59.35 -45.26 91.88 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.572 -0.851 . . . . 0.0 109.197 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -42.12 70.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.677 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 21.2 mm-40 -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.323 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.536 ' HB3' HG12 ' A' ' 46' ' ' VAL . 3.6 t80 -99.31 -75.67 0.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.765 0.793 . . . . 0.0 112.607 -166.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.536 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -98.33 142.06 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.575 -163.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.631 177.114 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.522 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.2 tm? . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.764 ' HA ' HD13 ' A' ' 11' ' ' ILE . 47.0 t -65.62 -24.11 66.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.172 175.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -72.24 -32.25 66.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.231 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -60.1 -45.15 93.89 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.7 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.764 HD13 ' HA ' ' A' ' 8' ' ' SER . 82.5 mt -51.74 -48.82 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.83 172.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 13.4 mm-40 -62.4 -24.59 67.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.24 -178.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -67.43 -50.42 59.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.343 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.623 ' H ' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.42 -23.4 50.61 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.686 178.325 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.544 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 20.3 mmm -56.67 -38.17 71.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.626 170.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.7 t -69.49 -10.01 56.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.579 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -88.95 -15.78 33.41 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.9 -7.93 21.65 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.572 177.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.503 ' HB3' HD13 ' A' ' 42' ' ' LEU . 24.8 m-85 -56.13 156.58 5.4 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -174.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.5 m -99.04 137.19 37.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.573 -173.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.583 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 33.7 m-85 -59.61 -33.0 70.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.282 -177.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -55.11 -50.81 68.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 111.105 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.423 ' HB3' HG13 ' A' ' 46' ' ' VAL . 8.6 m-20 -79.73 -27.37 40.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.401 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.622 HG13 HD11 ' A' ' 42' ' ' LEU . 40.9 mt -56.3 -49.11 78.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.738 0.304 . . . . 0.0 110.448 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.664 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.03 -38.1 87.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.15 0.5 . . . . 0.0 109.685 176.746 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.68 ' O ' HG23 ' A' ' 29' ' ' VAL . 29.5 ttmt -57.7 -45.88 85.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.926 176.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.577 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -59.3 -41.1 88.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.028 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 25' ' ' GLN . 30.7 mt -64.84 -38.44 90.97 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.637 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -66.61 -32.33 57.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.481 -176.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.536 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -31.86 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.615 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -87.53 9.08 22.21 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.227 -177.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.587 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.8 pm0 43.1 49.58 5.48 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.191 0.52 . . . . 0.0 110.302 -174.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 46.07 39.71 6.2 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.813 1.245 . . . . 0.0 112.694 -174.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.587 ' ND2' HE21 ' A' ' 32' ' ' GLN . 35.6 m-20 -72.07 156.26 39.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.096 175.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.711 HG22 ' H ' ' A' ' 36' ' ' GLU . 2.1 tt -67.53 -68.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.27 0.557 . . . . 0.0 110.979 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.711 ' H ' HG22 ' A' ' 35' ' ' ILE . 40.0 mt-10 -76.07 -37.43 58.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.764 -174.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.615 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 12.4 tpt -62.3 -38.34 89.03 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.189 -0.605 . . . . 0.0 110.942 -174.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.41 -52.64 37.29 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.5 ptpt -60.98 -31.83 71.41 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.231 0.538 . . . . 0.0 110.698 179.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.49 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 75.1 m-20 -81.58 -28.83 33.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.727 -178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.536 HG13 HD13 ' A' ' 30' ' ' ILE . 9.0 mm -67.19 -39.07 82.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.738 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.251 177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD11 HG13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -61.06 -47.42 86.44 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.28 174.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.49 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 56.1 ttp85 -47.08 -44.2 20.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.52 174.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -77.73 -46.31 22.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.554 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.554 ' HB3' HG12 ' A' ' 46' ' ' VAL . 6.1 t80 -82.71 -64.15 1.23 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.665 0.745 . . . . 0.0 112.365 -167.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.554 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.1 OUTLIER -108.06 145.83 14.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.604 -1.18 . . . . 0.0 112.399 -165.029 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 C--N 1.319 -0.757 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.279 175.599 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.504 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 C--O 1.224 -0.253 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -63.09 -38.37 90.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.179 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.446 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 58.6 m -65.0 -28.17 69.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.553 174.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.47 ' OE1' HG13 ' A' ' 35' ' ' ILE . 1.4 tp10 -66.91 -42.92 84.6 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.532 ' O ' HD23 ' A' ' 14' ' ' LEU . 2.0 mp -52.26 -42.85 38.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 121.052 0.453 . . . . 0.0 110.515 169.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 36.3 mt-10 -63.82 -24.02 67.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.348 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -70.52 -50.49 37.24 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.158 -178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.657 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -72.48 -23.99 61.11 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.654 176.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.556 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -57.18 -34.29 68.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.072 175.262 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -67.06 -13.06 61.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.743 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.529 HE21 ' HA ' ' A' ' 14' ' ' LEU . 46.4 mt-30 -85.58 -12.22 52.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.649 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.2 -3.59 29.89 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.417 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.515 ' HB3' HD13 ' A' ' 42' ' ' LEU . 20.6 m-85 -58.13 157.99 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.479 0.657 . . . . 0.0 112.474 -174.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.451 ' HB2' ' HG2' ' A' ' 22' ' ' GLN . 1.3 p -95.84 135.19 37.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.667 -175.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.607 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 48.3 p90 -66.57 -26.91 67.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.118 -176.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HG2' ' HB2' ' A' ' 20' ' ' SER . 8.8 pt20 -63.13 -45.91 89.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.713 0.768 . . . . 0.0 109.954 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.513 ' HB3' HG13 ' A' ' 46' ' ' VAL . 20.9 m-20 -81.13 -29.13 34.86 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.485 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.657 HG12 HD21 ' A' ' 14' ' ' LEU . 39.8 mt -57.44 -48.53 82.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.177 173.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.651 ' HA ' HD12 ' A' ' 28' ' ' LEU . 54.3 tt0 -63.07 -39.94 96.21 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.688 ' O ' HG23 ' A' ' 29' ' ' VAL . 36.4 ttmt -53.88 -47.26 71.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.062 176.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.521 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -59.93 -41.79 92.57 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.328 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.651 HD12 ' HA ' ' A' ' 25' ' ' GLN . 31.4 mt -64.95 -36.57 84.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.778 -177.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.0 m -67.1 -30.52 49.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.197 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.728 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.67 -32.92 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-O 121.218 0.533 . . . . 0.0 109.579 174.189 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.597 ' HA ' ' SD ' ' A' ' 37' ' ' MET . . . -82.95 4.3 26.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.765 -177.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.452 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 42.49 43.83 3.3 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.602 0.715 . . . . 0.0 110.768 -172.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 58.1 49.05 12.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.725 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 1.2 m-80 -83.59 163.74 20.18 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 173.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.772 HG22 ' H ' ' A' ' 36' ' ' GLU . 2.8 tt -78.4 -64.22 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 121.606 0.717 . . . . 0.0 109.199 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.772 ' H ' HG22 ' A' ' 35' ' ' ILE . 12.2 pt-20 -76.29 -36.89 58.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.264 -174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.597 ' SD ' ' HA ' ' A' ' 31' ' ' ALA . 38.4 ttm -63.79 -29.66 70.84 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.723 0.297 . . . . 0.0 111.204 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.463 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -77.05 -52.83 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.7 ptpt -60.08 -29.89 68.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.05 0.453 . . . . 0.0 110.637 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -75.16 -36.92 61.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.799 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.728 HG13 HD13 ' A' ' 30' ' ' ILE . 10.6 mm -66.48 -38.6 82.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.047 177.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.596 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.66 -49.07 78.9 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.185 174.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.64 -45.77 66.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.477 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.81 -41.21 71.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 111.995 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 6.6 m-85 -93.84 -73.0 0.58 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.48 -170.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.513 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -96.08 139.44 19.17 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.4 -168.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.518 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.573 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 CA--C 1.523 -0.087 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.65 ' HA ' HD13 ' A' ' 11' ' ' ILE . 47.7 t -65.71 -32.17 73.57 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.943 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.1 m -63.78 -32.35 73.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.542 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.1 mm-40 -64.38 -48.31 75.93 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.65 HD13 ' HA ' ' A' ' 8' ' ' SER . 69.9 mt -52.84 -51.15 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.46 171.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.664 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -57.53 -27.51 62.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.771 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 3.0 t-20 -60.81 -50.65 72.59 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.544 0.211 . . . . 0.0 110.745 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.918 ' HA ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -83.96 -24.42 30.66 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 119.166 -1.013 . . . . 0.0 110.946 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.664 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.11 -39.69 87.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.91 175.587 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -66.07 -17.4 64.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.044 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.918 HE21 ' HA ' ' A' ' 14' ' ' LEU . 40.7 mt-30 -80.43 -16.82 53.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.964 0.412 . . . . 0.0 110.951 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.72 -2.18 24.61 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.316 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.475 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.3 m-85 -59.08 166.96 1.85 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.17 0.509 . . . . 0.0 111.739 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -104.71 133.98 48.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.992 -172.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.584 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 31.5 p90 -65.16 -28.57 69.5 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.927 -170.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -62.23 -52.14 64.96 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.008 0.432 . . . . 0.0 110.878 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.596 ' HB3' HG13 ' A' ' 46' ' ' VAL . 6.4 m-20 -74.74 -25.01 58.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.352 177.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.66 HG13 HD11 ' A' ' 42' ' ' LEU . 42.1 mt -60.66 -49.5 84.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.002 0.429 . . . . 0.0 110.05 173.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.7 ' HA ' HD12 ' A' ' 28' ' ' LEU . 29.6 tt0 -63.9 -37.31 86.91 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.381 176.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.677 ' O ' HG21 ' A' ' 29' ' ' VAL . 37.4 ttmt -54.66 -50.61 67.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.035 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.497 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -56.64 -41.1 76.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.087 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.7 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.0 mt -63.95 -37.93 89.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.677 HG21 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -68.97 -30.41 46.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.06 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.658 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.61 -27.42 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.139 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.579 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -91.33 10.68 26.4 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.768 -176.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 2.7 pm0 43.15 46.91 5.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.275 0.56 . . . . 0.0 110.639 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 51.61 33.2 10.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.224 1.41 . . . . 0.0 113.277 -176.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.409 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 11.7 m-20 -70.99 149.69 46.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.339 174.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.646 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.2 tt -65.77 -59.69 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-O 121.605 0.716 . . . . 0.0 110.4 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.646 ' H ' HG22 ' A' ' 35' ' ' ILE . 12.3 pt-20 -75.53 -40.48 56.9 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.982 -172.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.579 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 43.0 tpp -67.71 -32.79 73.67 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.886 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -68.54 -51.92 37.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.893 0.377 . . . . 0.0 111.808 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 18.7 ptpt -62.65 -29.24 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.638 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -77.08 -39.9 48.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.658 HG13 HD13 ' A' ' 30' ' ' ILE . 11.9 mm -63.74 -38.79 83.23 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.402 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.66 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -60.29 -48.5 81.46 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.083 173.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -40.9 65.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.667 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.94 -31.99 57.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.028 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.485 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 11.4 m-85 -106.48 -80.56 0.56 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.18 135.27 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.164 -170.819 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.4 p . . . . . 0 C--N 1.318 -0.781 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.648 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.529 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.4 tm? . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.524 ' HA ' HD11 ' A' ' 11' ' ' ILE . 38.6 t -65.69 -24.67 67.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.193 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.1 t -70.0 -30.83 68.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.534 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 73.2 mm-40 -58.75 -46.87 86.47 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.524 HD11 ' HA ' ' A' ' 8' ' ' SER . 3.0 mp -53.09 -50.34 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.779 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.562 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 5.7 mm-40 -61.85 -24.68 67.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.665 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.525 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 9.6 t-20 -63.87 -50.9 67.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.623 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -80.22 -22.91 41.32 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.956 179.119 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.564 ' N ' HD22 ' A' ' 14' ' ' LEU . 12.9 mmm -56.58 -38.0 71.38 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.632 171.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -64.79 -12.09 43.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.724 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -92.26 -14.98 28.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.606 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.77 -5.04 22.65 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.73 176.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.738 ' HB3' HD13 ' A' ' 42' ' ' LEU . 41.9 m-85 -59.57 163.77 3.98 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 111.686 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 24' ' ' ILE . 53.4 m -108.78 136.3 48.58 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -171.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.546 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.6 m-85 -57.56 -36.97 72.36 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.638 -174.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.93 -50.17 69.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.919 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.764 ' HB3' HG13 ' A' ' 46' ' ' VAL . 6.5 m-20 -81.82 -23.12 36.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.546 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 42.2 mt -58.19 -49.83 80.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.794 0.33 . . . . 0.0 110.188 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.694 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.8 tt0 -62.39 -38.17 88.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.342 0.592 . . . . 0.0 109.626 176.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 20.8 mtpp -58.64 -38.89 79.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.058 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.477 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -66.37 -38.96 88.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.523 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.694 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.7 mt -64.11 -37.24 86.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.521 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 26' ' ' LYS . 5.1 m -68.53 -30.89 48.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.344 -177.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.687 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.57 -29.12 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.718 0.771 . . . . 0.0 109.708 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.639 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -88.17 8.44 27.0 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.993 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 40.43 52.0 2.9 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.531 0.681 . . . . 0.0 111.008 -172.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 47.01 44.71 15.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.982 1.313 . . . . 0.0 112.613 -174.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 7.9 m-20 -79.38 154.87 28.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.05 175.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.726 HG22 ' H ' ' A' ' 36' ' ' GLU . 2.0 tt -65.56 -70.6 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.782 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.726 ' H ' HG22 ' A' ' 35' ' ' ILE . 47.6 mm-40 -75.35 -36.89 60.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.618 -173.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.639 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 14.4 tpt -63.02 -36.3 83.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.225 -174.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.36 -52.61 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.921 0.391 . . . . 0.0 111.825 178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.5 ptpt -62.93 -29.67 70.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.927 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.6 m-20 -78.32 -32.53 49.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.328 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.687 HG13 HD13 ' A' ' 30' ' ' ILE . 13.0 mm -67.4 -38.51 80.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.199 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.738 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -58.09 -54.14 50.31 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.434 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 46.8 ttt180 -44.9 -52.82 8.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.563 175.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.87 -44.71 84.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.774 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 20.7 m-85 -99.94 -80.68 0.47 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -85.61 125.91 40.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -172.505 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.64 -178.561 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.608 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.5 tm? . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.739 ' HA ' HD13 ' A' ' 11' ' ' ILE . 30.6 t -56.67 -35.71 68.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 174.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -63.98 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.498 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 35' ' ' ILE . 2.8 mm-40 -63.48 -48.05 79.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 176.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.739 HD13 ' HA ' ' A' ' 8' ' ' SER . 14.5 mt -59.96 -49.85 82.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.118 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.646 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.1 mt-10 -63.06 -25.19 68.26 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.675 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -62.36 -51.29 68.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.456 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.663 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.19 -24.03 35.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.64 176.605 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.826 ' HE2' ' HB3' ' A' ' 21' ' ' TYR . 1.2 mmt -54.12 -29.0 43.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.785 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 t -75.5 -9.69 58.8 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.186 0.517 . . . . 0.0 110.438 -169.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.641 HE21 ' HA ' ' A' ' 14' ' ' LEU . 2.3 mp0 -80.88 -23.82 38.75 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.301 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.46 4.8 21.61 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.291 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.406 ' HB3' HD13 ' A' ' 42' ' ' LEU . 34.7 m-85 -61.96 167.79 3.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.054 0.454 . . . . 0.0 111.186 -177.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.8 m -104.14 130.71 51.88 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.336 -170.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.826 ' HB3' ' HE2' ' A' ' 15' ' ' MET . 10.9 p90 -67.09 -23.64 65.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.519 -170.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.52 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -59.82 -53.9 52.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.083 0.468 . . . . 0.0 110.578 177.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.695 ' HB3' HG13 ' A' ' 46' ' ' VAL . 1.5 m-20 -82.93 -23.83 33.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.497 -179.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.609 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 24.3 mt -59.86 -50.2 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.644 0.259 . . . . 0.0 110.381 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.734 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.5 tt0 -65.11 -34.73 79.09 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.674 ' O ' HG23 ' A' ' 29' ' ' VAL . 8.0 ttpp -61.34 -40.28 93.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.12 177.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.457 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -63.23 -39.59 95.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.687 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.734 HD12 ' HA ' ' A' ' 25' ' ' GLN . 35.7 mt -64.93 -36.59 84.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.494 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.674 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.6 m -69.33 -30.04 44.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.413 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.744 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.37 -31.24 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -88.39 11.56 16.54 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.53 -177.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? 36.05 43.97 0.23 Allowed 'General case' 0 N--CA 1.474 0.764 0 O-C-N 124.019 0.825 . . . . 0.0 112.316 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.512 ' HB3' HD22 ' A' ' 7' ' ' LEU . 16.0 m120 68.76 29.73 5.09 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.035 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 14.5 m-20 -72.62 151.13 42.48 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 120.999 0.428 . . . . 0.0 110.603 171.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.752 HG22 ' H ' ' A' ' 36' ' ' GLU . 11.8 tt -72.79 -53.1 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.363 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.752 ' H ' HG22 ' A' ' 35' ' ' ILE . 19.2 mt-10 -75.62 -45.26 38.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.98 -175.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.618 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 17.4 tpt -63.59 -30.16 71.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 -175.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.09 -51.98 12.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.875 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.53 ' HE3' HG12 ' A' ' 35' ' ' ILE . 19.3 ptpt -60.9 -31.16 70.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.002 0.43 . . . . 0.0 110.51 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -69.4 -41.77 75.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.448 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.744 HG13 HD13 ' A' ' 30' ' ' ILE . 14.1 mm -65.83 -38.61 82.6 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.232 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.599 HD11 HG13 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.3 -50.38 73.86 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 172.535 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -53.76 -36.66 62.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.283 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -81.36 -31.09 33.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.015 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.525 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 16.7 m-85 -110.31 -79.8 0.58 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.2 -171.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.695 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -97.18 127.27 49.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.049 -173.304 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.709 -175.425 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.553 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 CA--C 1.523 -0.084 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.4 t -60.11 -35.03 74.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.018 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.2 m -60.98 -29.57 69.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.464 177.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.584 ' HB3' ' HB ' ' A' ' 35' ' ' ILE . 3.5 mm-40 -63.24 -49.47 73.99 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.52 ' O ' HD11 ' A' ' 14' ' ' LEU . 3.7 mp -58.51 -49.3 82.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.42 174.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 50.4 mt-10 -63.51 -24.49 67.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.995 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -61.9 -50.09 73.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.504 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.605 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.15 -23.27 38.39 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.275 178.104 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 22.4 mmm -57.28 -26.39 60.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.787 177.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.6 p -61.41 -22.78 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.956 0.408 . . . . 0.0 111.104 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -79.62 -20.41 46.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.071 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.83 6.16 26.73 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.511 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -60.4 172.88 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.5 m -112.4 134.47 53.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.468 -170.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.431 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 70.3 m-85 -58.54 -35.37 72.21 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.725 -173.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.506 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -56.35 -54.33 46.77 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.557 0.536 . . . . 0.0 111.724 -176.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.657 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 5.9 m-20 -80.74 -23.56 39.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.703 HG13 HD11 ' A' ' 42' ' ' LEU . 23.8 mt -59.12 -50.08 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.919 0.39 . . . . 0.0 110.084 173.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.716 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.9 tt0 -60.8 -40.77 93.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.533 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 16.1 mtpp -57.66 -43.69 85.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.069 175.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -63.37 -42.06 98.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.359 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.716 HD12 ' HA ' ' A' ' 25' ' ' GLN . 39.2 mt -61.83 -37.28 83.87 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.931 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.5 m -69.03 -30.98 48.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.293 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.754 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.88 -30.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.437 0.637 . . . . 0.0 109.349 175.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.633 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -88.3 12.99 12.55 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.422 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 40.35 52.17 2.86 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.875 0.734 . . . . 0.0 110.88 -176.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.52 51.35 15.52 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.449 -1.25 . . . . 0.0 112.856 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 7.9 m-20 -93.48 158.77 15.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.36 174.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.81 HG22 ' H ' ' A' ' 36' ' ' GLU . 6.2 tt -77.44 -60.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.003 176.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.81 ' H ' HG22 ' A' ' 35' ' ' ILE . 3.5 mt-10 -73.49 -43.82 59.26 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.617 -174.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.633 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 16.0 tpt -62.95 -33.98 76.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.35 -175.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.535 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -72.1 -51.95 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.791 176.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.648 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 10.4 ptpt -60.56 -31.22 70.34 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.095 0.474 . . . . 0.0 110.76 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 75.2 m-20 -78.56 -35.08 46.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.577 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.754 HG13 HD13 ' A' ' 30' ' ' ILE . 11.4 mm -67.12 -38.78 81.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.595 174.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.703 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -58.49 -49.07 78.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.161 172.575 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.01 -33.82 62.94 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.197 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 34.7 mm-40 -83.02 -25.87 31.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.957 0.408 . . . . 0.0 112.007 178.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -110.9 -75.17 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.466 0.65 . . . . 0.0 112.17 -171.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.447 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -96.84 146.23 7.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.036 -168.26 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.5 p . . . . . 0 C--N 1.318 -0.774 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.767 178.662 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.577 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.7 tm? . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.431 ' O ' ' HG2' ' A' ' 12' ' ' GLU . 43.1 t -62.52 -30.75 71.51 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.16 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.9 m -60.85 -31.11 70.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.151 174.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.915 ' HB3' HD12 ' A' ' 35' ' ' ILE . 18.9 mm-40 -60.69 -49.89 75.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.077 0.465 . . . . 0.0 109.794 172.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.4 ' O ' HD23 ' A' ' 14' ' ' LEU . 2.8 mp -54.15 -46.08 66.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.611 173.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -59.26 -25.31 63.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.594 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 7.0 t-20 -64.04 -51.76 62.62 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.73 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -78.85 -23.49 44.94 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.136 179.159 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.19 -39.47 86.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.352 173.662 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.6 t -69.74 -11.92 61.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.154 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -86.32 -22.5 26.71 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.256 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 122.87 -9.3 9.11 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.054 176.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.884 ' HB3' HD13 ' A' ' 42' ' ' LEU . 50.2 m-85 -61.03 162.49 7.05 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.933 0.397 . . . . 0.0 111.933 -175.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -100.82 133.23 45.6 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.86 -35.96 64.58 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.92 -172.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -62.87 -51.72 65.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 -175.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.743 ' CB ' HG13 ' A' ' 46' ' ' VAL . 12.7 m-20 -79.08 -23.52 44.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.76 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.73 HG12 HD21 ' A' ' 14' ' ' LEU . 34.9 mt -58.69 -50.08 80.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 172.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.724 ' HA ' HD12 ' A' ' 28' ' ' LEU . 18.8 tm0? -62.98 -39.66 95.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.702 ' O ' HG21 ' A' ' 29' ' ' VAL . 43.4 mtpt -57.84 -45.28 86.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.39 175.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.5 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -59.84 -37.59 79.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.83 0.348 . . . . 0.0 110.816 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.2 mt -64.23 -38.59 91.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.872 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.702 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -68.79 -30.96 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.737 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.51 -28.43 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.647 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -91.03 12.22 20.48 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.596 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 2.6 pm0 43.33 47.68 5.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.447 0.641 . . . . 0.0 110.665 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.63 35.97 12.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.265 1.426 . . . . 0.0 113.34 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 9.0 m-20 -77.04 142.23 39.96 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.585 169.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.915 HD12 ' HB3' ' A' ' 10' ' ' GLU . 2.4 tp -68.01 -54.99 18.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-O 121.253 0.549 . . . . 0.0 110.76 174.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.693 ' H ' HG22 ' A' ' 35' ' ' ILE . 25.7 mt-10 -65.75 -48.44 71.87 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.677 -174.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.647 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 53.4 tpp -64.97 -32.31 73.98 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.712 -176.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 34' ' ' ASN . . . -70.5 -51.88 25.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 16.5 ptpt -62.14 -29.05 70.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.107 0.48 . . . . 0.0 110.149 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.2 -39.56 60.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.014 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.737 HG13 HD13 ' A' ' 30' ' ' ILE . 10.5 mm -63.88 -38.87 83.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.356 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.884 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 172.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -54.71 -34.79 62.88 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.482 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -86.21 -27.6 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.878 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 8.0 m-85 -114.76 -79.37 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.187 0.518 . . . . 0.0 111.956 -174.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.743 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -98.02 117.69 43.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.855 -175.154 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.552 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 1.7 p . . . . . 0 C--N 1.312 -1.024 0 CA-C-O 121.502 0.668 . . . . 0.0 111.576 -174.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.526 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 121.586 0.708 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -66.93 -24.33 66.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.27 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.7 m -71.07 -31.78 68.28 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.767 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.93 -47.19 86.79 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.721 HD13 HD13 ' A' ' 28' ' ' LEU . 87.8 mt -56.19 -53.67 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.755 174.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 11.5 mm-40 -57.21 -25.84 59.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.958 -176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -66.34 -51.09 60.78 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.867 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.708 HD12 ' HZ2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -79.64 -22.65 43.31 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.811 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.537 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 16.6 mmm -53.73 -38.87 64.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.748 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.9 m -71.63 -3.07 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.003 -177.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -87.98 -16.76 32.86 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 -2.68 24.16 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.76 176.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.0 m-85 -61.36 168.57 2.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.191 0.52 . . . . 0.0 111.974 -176.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 24' ' ' ILE . 58.8 m -113.67 136.08 53.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.119 -169.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.0 m-85 -59.55 -34.92 73.27 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.139 -174.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -53.61 -50.59 65.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.018 0.437 . . . . 0.0 111.191 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.527 ' HB3' HG13 ' A' ' 46' ' ' VAL . 23.1 m-20 -82.49 -26.86 32.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.784 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.611 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 41.3 mt -60.17 -49.98 82.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.201 0.524 . . . . 0.0 110.398 174.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.91 -35.49 80.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.961 178.192 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.687 ' O ' HG21 ' A' ' 29' ' ' VAL . 1.5 ttmm -59.04 -45.98 89.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.829 176.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.412 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -58.39 -40.6 82.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.95 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.4 mt -62.19 -40.1 94.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.688 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.687 HG21 ' O ' ' A' ' 26' ' ' LYS . 3.6 m -67.63 -31.53 52.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.264 -175.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.588 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -27.66 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-O 121.726 0.774 . . . . 0.0 109.265 177.035 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.637 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -91.94 13.62 18.07 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.434 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 42.15 43.78 2.95 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.643 0.589 . . . . 0.0 111.527 -175.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 55.25 57.05 5.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.795 -175.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.549 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 3.7 t-20 -90.26 154.13 19.96 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.494 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.705 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.6 tt -67.3 -64.92 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.913 169.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.705 ' H ' HG22 ' A' ' 35' ' ' ILE . 26.8 mt-10 -71.64 -49.78 36.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.309 -175.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.797 ' HA ' ' HE3' ' A' ' 37' ' ' MET . 3.2 tpt -62.22 -34.58 76.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.342 -168.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -69.68 -52.73 23.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.799 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.708 ' HZ2' HD12 ' A' ' 14' ' ' LEU . 1.4 ptpm? -66.01 -29.03 69.33 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.773 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 89.4 m-20 -76.14 -32.64 59.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.205 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.588 HG13 HD13 ' A' ' 30' ' ' ILE . 10.8 mm -68.01 -38.41 79.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.186 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.663 ' HA ' HG11 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -57.04 -51.39 69.48 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 172.14 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 21.9 ttp180 -48.45 -48.96 37.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.89 175.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 43.8 mt-10 -77.78 -24.34 48.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.862 -175.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.549 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 10.2 m-85 -116.16 -75.92 0.58 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -171.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.663 HG11 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -86.37 138.3 19.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.383 -170.567 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 C--N 1.317 -0.825 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.433 176.152 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.576 ' O ' HD12 ' A' ' 7' ' ' LEU . 2.3 tm? . . . . . 0 N--CA 1.461 0.125 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.573 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 45.6 t -63.75 -26.68 68.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.807 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.4 m -69.39 -30.79 68.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.999 173.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.591 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 4.2 mm-40 -63.0 -34.61 77.92 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.573 ' HB ' ' O ' ' A' ' 8' ' ' SER . 51.2 mt -55.03 -48.62 75.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.895 171.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.673 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 44.3 mt-10 -58.16 -25.85 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.012 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.591 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -64.55 -48.05 76.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.176 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.64 ' H ' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.06 -24.28 32.8 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.669 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.673 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 23.9 mmm -55.15 -45.6 75.68 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.913 176.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.4 p -68.81 -3.53 12.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.996 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -88.22 -12.88 42.49 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.192 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.69 -8.06 22.02 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.192 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.812 ' HB3' HD11 ' A' ' 42' ' ' LEU . 37.3 m-85 -61.75 157.22 18.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.124 0.488 . . . . 0.0 111.183 -176.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.2 m -100.87 129.51 46.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.338 0.59 . . . . 0.0 111.619 -171.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.677 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.2 p90 -60.71 -26.4 67.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.231 -174.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -59.14 -51.62 69.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.074 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.648 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -82.28 -22.61 35.66 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.024 177.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.677 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 39.6 mt -57.76 -50.24 78.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.83 0.348 . . . . 0.0 110.674 174.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.741 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.5 tt0 -61.85 -38.35 87.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.607 0.717 . . . . 0.0 109.529 176.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.655 ' O ' HG21 ' A' ' 29' ' ' VAL . 34.4 mtpt -61.4 -40.11 93.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.214 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.407 ' O ' HG22 ' A' ' 30' ' ' ILE . . . -65.27 -38.06 89.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.89 176.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.741 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.9 mt -63.56 -36.27 83.23 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.651 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.655 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -70.04 -30.76 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.102 -177.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.639 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -26.62 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.401 0.619 . . . . 0.0 109.486 175.523 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.602 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -92.27 10.79 28.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.587 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.5 pm0 43.54 47.18 6.16 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.248 0.546 . . . . 0.0 110.676 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 47.4 43.23 15.23 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.788 1.235 . . . . 0.0 112.89 -174.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.587 ' ND2' HE21 ' A' ' 32' ' ' GLN . 81.2 m-20 -81.68 136.69 35.49 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.61 170.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.599 HG22 ' HG3' ' A' ' 36' ' ' GLU . 4.7 tt -61.31 -48.03 90.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.805 176.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.599 ' HG3' HG22 ' A' ' 35' ' ' ILE . 27.0 mt-10 -72.86 -49.72 28.34 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.134 -174.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.602 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 59.6 tpp -67.43 -34.21 76.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.227 -172.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.79 -51.95 59.48 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -62.51 -29.9 70.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.98 0.419 . . . . 0.0 110.502 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -77.58 -37.12 51.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.639 HG13 HD13 ' A' ' 30' ' ' ILE . 15.4 mm -65.54 -37.82 80.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.544 177.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.812 HD11 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -55.43 -57.72 10.71 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.12 -41.16 16.9 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.292 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.02 -38.87 31.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 17.9 m-85 -101.23 -71.58 0.71 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.334 0.588 . . . . 0.0 112.229 -171.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.785 HG11 ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -92.09 134.82 29.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.213 -170.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--N 1.314 -0.97 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.971 -175.9 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.552 HD22 ' C ' ' A' ' 7' ' ' LEU . 4.7 tt . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 39.9 t -57.95 -35.26 70.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.492 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.6 m -66.36 -31.96 73.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.507 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 7' ' ' LEU . 2.1 mm-40 -62.08 -45.55 93.03 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.75 -48.99 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.65 174.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.589 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 46.6 mt-10 -61.15 -26.54 67.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -62.95 -50.37 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.818 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.615 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.02 -23.03 36.16 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.055 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.589 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 10.1 mmm -56.24 -45.73 79.86 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.036 175.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.8 p -72.45 -2.51 19.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.071 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -85.12 -19.06 32.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.29 -3.52 18.41 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.654 177.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.602 ' HB3' HD13 ' A' ' 42' ' ' LEU . 45.2 m-85 -64.13 168.76 5.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.008 0.432 . . . . 0.0 111.383 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.9 m -105.95 131.03 53.74 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.262 0.553 . . . . 0.0 111.935 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.541 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.2 p90 -61.46 -30.58 70.69 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.945 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.465 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 22.5 pt20 -56.89 -52.96 63.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.962 0.411 . . . . 0.0 110.981 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.701 ' CB ' HG13 ' A' ' 46' ' ' VAL . 9.2 m-20 -80.87 -23.15 39.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.541 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 54.0 mt -59.26 -50.21 80.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.713 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -66.02 -34.54 78.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.787 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 40.9 mtpt -59.86 -46.35 89.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.985 174.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -58.74 -38.21 77.91 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.196 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.713 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.3 mt -63.57 -37.52 87.63 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -69.65 -30.37 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.14 -177.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.78 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.54 -28.08 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-O 121.448 0.642 . . . . 0.0 109.335 176.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -92.88 11.99 25.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.565 -176.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 41.85 47.89 3.72 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.456 0.646 . . . . 0.0 110.458 -174.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.488 ' ND2' HD11 ' A' ' 7' ' ' LEU . 2.4 p-10 48.32 40.24 14.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.923 1.289 . . . . 0.0 113.165 -175.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -74.65 148.87 40.27 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.393 171.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.725 HG22 ' H ' ' A' ' 36' ' ' GLU . 3.5 tt -65.33 -59.66 3.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.25 0.548 . . . . 0.0 110.979 173.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.725 ' H ' HG22 ' A' ' 35' ' ' ILE . 44.7 mt-10 -71.3 -45.96 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.015 -173.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.648 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 15.6 tpt -64.92 -33.22 75.5 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.912 -172.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -68.76 -52.42 30.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.725 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -63.81 -29.98 71.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.095 0.474 . . . . 0.0 110.635 179.002 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -75.56 -35.15 60.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.622 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.78 HG13 HD13 ' A' ' 30' ' ' ILE . 12.6 mm -65.48 -38.32 82.18 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.449 175.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.602 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.32 -54.51 45.93 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 171.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 tmm_? -52.93 -40.32 63.52 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.91 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.97 -44.31 61.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 111.966 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 29.2 m-85 -100.38 -80.55 0.48 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.67 -172.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.701 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.82 122.03 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.111 -172.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.8 m . . . . . 0 C--N 1.312 -1.052 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.553 -176.517 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.551 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.1 t -62.49 -29.66 70.7 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.093 175.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.2 m -67.59 -30.95 70.68 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.531 176.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.17 -46.13 90.32 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.0 mp -54.17 -51.55 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.506 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.648 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 63.6 mm-40 -58.84 -26.25 63.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.651 -178.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -62.78 -50.85 69.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.414 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.87 -23.84 36.1 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.25 177.629 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.648 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -56.21 -32.48 64.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.941 176.542 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 t -59.35 -22.59 61.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.824 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -78.99 -21.53 46.9 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.245 -179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.79 1.65 22.69 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.744 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.455 ' O ' ' HE2' ' A' ' 15' ' ' MET . 30.9 m-85 -57.62 167.4 1.08 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 112.305 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 p -99.25 135.22 40.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.333 -173.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.455 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 7.5 m-85 -62.7 -31.83 72.81 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.17 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 7.3 pt20 -62.17 -48.43 80.12 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.609 0.719 . . . . 0.0 110.504 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.772 ' HB3' HG13 ' A' ' 46' ' ' VAL . 40.4 m-20 -82.75 -29.01 30.02 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.456 -177.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.531 HG13 HD11 ' A' ' 42' ' ' LEU . 23.1 mt -57.14 -49.11 80.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.026 172.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.3 tt0 -62.49 -39.83 94.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.914 176.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.64 ' O ' HG22 ' A' ' 29' ' ' VAL . 3.2 ttmm -55.63 -42.94 75.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.958 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.461 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -63.99 -41.6 97.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.957 178.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 25' ' ' GLN . 28.6 mt -63.62 -40.23 96.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.463 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.64 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.8 m -64.86 -31.21 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.211 -176.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.657 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.97 -32.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.334 0.588 . . . . 0.0 109.58 175.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -85.47 8.68 18.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.234 -177.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 44.65 40.49 4.14 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.755 0.659 . . . . 0.0 110.999 -175.321 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 61.82 55.32 2.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.38 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.441 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 9.9 m-20 -103.05 145.0 30.55 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.685 175.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.716 HG22 ' H ' ' A' ' 36' ' ' GLU . 4.3 tt -62.6 -57.8 10.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.836 0.35 . . . . 0.0 111.384 176.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.716 ' H ' HG22 ' A' ' 35' ' ' ILE . 43.8 mt-10 -68.58 -50.87 48.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.516 -176.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.648 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 15.7 tpt -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.243 -170.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -71.53 -52.19 19.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.771 0.319 . . . . 0.0 111.822 177.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 1.2 ptpm? -63.89 -28.99 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.907 0.384 . . . . 0.0 110.287 179.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.541 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 97.5 m-20 -76.36 -31.01 57.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.903 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.657 HG13 HD13 ' A' ' 30' ' ' ILE . 13.6 mm -70.57 -38.32 73.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.875 174.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.531 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -60.39 -48.51 81.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 170.88 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.541 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 8.7 tpm_? -46.02 -48.91 16.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.287 175.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 33.7 mm-40 -74.72 -43.95 52.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.517 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 23.0 m-85 -97.88 -74.92 0.56 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.592 0.711 . . . . 0.0 112.516 -170.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.772 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -100.44 126.21 54.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.93 -169.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 p . . . . . 0 C--N 1.312 -1.042 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.207 175.831 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.545 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 22.7 t -59.79 -33.76 72.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.853 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.5 m -64.24 -30.71 71.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.143 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.535 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.3 mm-40 -60.66 -45.96 92.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.2 mp -56.08 -46.29 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.284 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 38.8 mt-10 -59.17 -26.5 64.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.093 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.535 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -63.38 -51.39 66.06 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.675 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -79.91 -23.42 41.81 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 119.196 -1.001 . . . . 0.0 110.165 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.544 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 12.2 mmm -57.94 -35.93 71.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.385 177.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.8 t -73.74 1.23 10.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.657 -177.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -94.24 -18.13 21.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.719 0.295 . . . . 0.0 110.404 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.75 0.35 24.46 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.574 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -63.61 166.99 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.237 0.542 . . . . 0.0 112.192 -176.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -102.01 130.32 48.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.369 -172.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' HA ' HD12 ' A' ' 24' ' ' ILE . 41.1 p90 -62.85 -30.4 71.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.611 -171.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.609 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 1.5 pt20 -64.32 -49.7 70.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.192 0.52 . . . . 0.0 110.629 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.656 ' HB3' HG13 ' A' ' 46' ' ' VAL . 21.4 m-20 -73.16 -31.1 64.04 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.766 177.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.675 HG12 HD21 ' A' ' 14' ' ' LEU . 39.4 mt -56.53 -48.13 80.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.191 0.519 . . . . 0.0 110.199 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -64.35 -38.0 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.251 178.287 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.673 ' O ' HG21 ' A' ' 29' ' ' VAL . 8.1 ttmt -60.59 -42.83 97.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.322 176.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.489 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -61.72 -36.34 80.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.02 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 25' ' ' GLN . 41.8 mt -65.77 -39.41 90.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.776 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.673 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -67.16 -30.68 50.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.222 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.741 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -85.87 -27.24 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.705 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -92.94 10.69 30.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.416 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 45.88 39.24 5.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.526 0.679 . . . . 0.0 111.109 -174.55 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m120 62.18 48.26 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.96 -177.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 77.2 m-20 -94.13 150.68 20.11 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.634 173.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.687 HG22 ' HG3' ' A' ' 36' ' ' GLU . 4.6 tt -70.6 -53.63 21.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.341 0.591 . . . . 0.0 110.835 175.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 35' ' ' ILE . 25.4 mt-10 -71.65 -46.02 60.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.417 -172.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.705 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 49.5 tpp -68.25 -31.04 70.23 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.818 0.342 . . . . 0.0 110.861 -174.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -70.73 -51.62 26.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.724 177.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 ptpt -61.06 -29.61 69.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.401 . . . . 0.0 110.517 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -77.4 -34.63 54.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.801 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.741 HG13 HD13 ' A' ' 30' ' ' ILE . 13.2 mm -67.62 -37.65 79.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.711 176.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.645 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.53 -50.37 74.02 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -53.77 -28.95 37.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.394 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -89.28 -41.3 12.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.261 0.553 . . . . 0.0 111.731 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -95.34 -74.6 0.55 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.82 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.656 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -102.3 126.72 56.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.562 0.696 . . . . 0.0 112.745 -169.902 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 C--N 1.314 -0.944 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.335 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.568 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.1 tm? . . . . . 0 C--O 1.226 -0.151 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 42.7 t -57.58 -35.98 71.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.045 174.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -63.4 -31.01 72.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.617 177.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.573 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.4 mm-40 -61.18 -48.8 79.87 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.431 HG12 HD13 ' A' ' 28' ' ' LEU . 3.5 mp -55.53 -48.66 77.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.475 173.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.2 mt-10 -60.68 -25.87 66.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.25 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.573 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 5.5 t-20 -61.13 -51.53 68.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.654 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.632 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -82.85 -23.62 33.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.449 -0.9 . . . . 0.0 110.597 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.637 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 8.8 mmm -57.06 -45.95 82.85 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.569 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -66.44 -13.12 60.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.901 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -80.35 -15.88 55.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.818 0.342 . . . . 0.0 110.106 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.81 -2.89 24.46 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.604 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.646 ' HB3' HD13 ' A' ' 42' ' ' LEU . 35.1 m-85 -63.93 170.95 3.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.982 0.42 . . . . 0.0 111.607 -177.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.6 m -106.84 129.15 54.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.532 0.682 . . . . 0.0 112.448 -172.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.465 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.8 p90 -55.64 -33.63 64.23 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.733 -173.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -59.6 -50.36 74.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.375 -177.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.666 ' CB ' HG13 ' A' ' 46' ' ' VAL . 2.5 m-20 -82.15 -23.58 35.51 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.941 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.632 HG12 HD21 ' A' ' 14' ' ' LEU . 44.3 mt -59.0 -50.41 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.439 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.689 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.03 -36.13 80.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.57 176.916 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.667 ' O ' HG23 ' A' ' 29' ' ' VAL . 9.7 ttpp -61.73 -43.44 98.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.179 177.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.692 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -58.94 -41.1 86.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.837 177.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 25' ' ' GLN . 27.6 mt -63.19 -38.31 90.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.891 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.55 -30.51 49.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.443 -176.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.812 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.13 -24.97 6.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.831 0.824 . . . . 0.0 109.284 174.746 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.81 ' CB ' ' HB3' ' A' ' 37' ' ' MET . . . -87.72 3.96 45.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.459 -175.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.504 HE21 ' ND2' ' A' ' 34' ' ' ASN . 2.2 pm0 43.67 40.15 2.82 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.532 0.682 . . . . 0.0 110.226 -171.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.2 m120 61.47 39.47 14.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.347 -1.297 . . . . 0.0 112.146 -177.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.504 ' ND2' HE21 ' A' ' 32' ' ' GLN . 58.2 m-20 -83.13 140.75 32.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.709 0.29 . . . . 0.0 110.48 172.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.697 HG22 ' H ' ' A' ' 36' ' ' GLU . 6.0 tt -59.05 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.199 176.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.697 ' H ' HG22 ' A' ' 35' ' ' ILE . 40.4 mt-10 -72.12 -42.78 65.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.935 -175.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.81 ' HB3' ' CB ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER -61.14 -34.17 74.57 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.423 -175.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.692 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -70.27 -52.15 25.13 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.481 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HE3' HG12 ' A' ' 35' ' ' ILE . 18.0 ptpt -63.12 -29.21 70.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.722 178.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.432 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.1 m-20 -80.52 -39.26 28.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.502 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.812 HG13 HD13 ' A' ' 30' ' ' ILE . 11.0 mm -66.15 -38.24 81.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.186 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.646 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.76 -46.35 90.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 0.1 OUTLIER -53.71 -35.84 61.59 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.475 176.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.42 -32.63 22.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.975 0.417 . . . . 0.0 112.077 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 13.7 m-85 -108.46 -76.04 0.62 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -171.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.666 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -98.67 126.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.191 -171.017 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.7 m . . . . . 0 C--N 1.317 -0.846 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.98 -177.986 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.5 p 49.93 92.41 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.585 0.754 . . . . 0.0 112.611 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.69 85.83 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.419 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.3 p -68.35 127.08 93.29 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.056 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.34 -29.16 26.34 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 123.072 2.515 . . . . 0.0 113.01 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 9' ' ' SER . 52.9 mt-30 -77.27 -41.23 41.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 110.785 -175.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.515 ' O ' HD12 ' A' ' 7' ' ' LEU . 1.3 tm? -66.01 -41.66 90.73 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.8 t -66.31 -32.55 74.02 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.088 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 38.1 m -63.51 -29.78 71.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.02 173.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 65.4 mm-40 -61.31 -44.89 96.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 176.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.619 HD13 HD13 ' A' ' 28' ' ' LEU . 53.6 mt -54.76 -49.9 65.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.967 172.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.615 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 23.3 mm-40 -56.91 -28.7 62.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.395 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.496 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 2.8 t-20 -62.33 -51.25 68.37 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.419 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.653 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.72 -24.08 31.36 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.246 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.615 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 25.6 mmm -54.35 -45.63 72.79 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.328 172.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 t -61.92 -21.57 64.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.331 -0.849 . . . . 0.0 110.818 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -82.79 -12.52 57.43 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.705 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 115.54 -10.63 19.21 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.794 176.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.733 ' HB3' HD13 ' A' ' 42' ' ' LEU . 38.4 m-85 -55.07 153.04 6.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.531 . . . . 0.0 112.047 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.5 m -96.4 133.02 41.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.997 -171.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.589 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 42.0 p90 -64.12 -26.07 68.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.51 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.457 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 12.6 pt20 -60.39 -48.28 82.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.253 0.549 . . . . 0.0 110.347 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.555 ' HB3' HG13 ' A' ' 46' ' ' VAL . 7.1 m-20 -80.27 -25.35 39.51 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.495 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.589 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 46.6 mt -60.19 -50.2 81.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.517 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.62 -34.91 78.0 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.726 ' O ' HG21 ' A' ' 29' ' ' VAL . 23.7 ttpt -61.01 -46.41 90.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.155 176.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.544 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -58.17 -39.54 79.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.899 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.4 mt -64.12 -36.86 85.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.896 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.726 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.3 m -68.94 -31.25 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.191 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.692 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -87.16 -32.12 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -86.88 8.73 21.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.944 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.71 54.09 2.5 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.495 0.664 . . . . 0.0 110.68 -174.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 46.8 45.98 15.07 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.663 -174.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.472 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 0.6 OUTLIER -77.85 163.49 26.02 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 175.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.5 tt -73.32 -71.9 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.731 ' H ' HG22 ' A' ' 35' ' ' ILE . 50.0 mt-10 -78.1 -35.4 49.3 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.57 -175.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.472 ' HB3' ' HB2' ' A' ' 34' ' ' ASN . 31.6 ttm -59.74 -34.5 73.03 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.196 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.19 -52.45 14.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.308 . . . . 0.0 111.657 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.518 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 17.9 ptpt -62.42 -28.8 70.04 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.905 0.384 . . . . 0.0 110.768 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.95 -38.84 66.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.849 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.692 HG13 HD13 ' A' ' 30' ' ' ILE . 12.4 mm -65.98 -38.6 82.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.194 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.733 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.97 -44.85 94.19 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.276 -0.57 . . . . 0.0 109.491 174.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -45.34 81.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.789 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.09 -39.21 66.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.352 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -101.27 -84.49 0.44 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -170.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.56 HG11 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.09 148.45 10.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.905 -171.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 m -117.05 167.85 10.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.998 0.428 . . . . 0.0 111.164 -178.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.2 133.66 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.669 -177.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.6 m -89.89 -12.64 38.35 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 15.7 p -62.3 130.95 93.52 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.97 -178.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 3.0 Cg_exo -81.07 137.0 10.59 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 123.416 2.744 . . . . 0.0 112.98 -176.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 55' ' ' ALA . . . 62.07 88.24 0.09 Allowed 'General case' 0 C--O 1.231 0.082 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.047 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -87.16 -56.03 3.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.568 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.5 m -87.67 31.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.141 0.496 . . . . 0.0 111.552 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.52 ' HB3' ' HB2' ' A' ' 52' ' ' ALA . . . -84.32 25.25 0.88 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.988 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 87.3 m . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.358 -0.829 . . . . 0.0 109.386 176.765 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.931 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.819 HG23 ' HB2' ' A' ' 8' ' ' SER . 9.9 t -174.38 139.95 0.62 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.121 0.486 . . . . 0.0 110.652 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.46 -25.57 14.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.393 175.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -99.57 126.76 36.22 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.821 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.22 -32.36 21.0 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 123.165 2.577 . . . . 0.0 112.393 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.29 -32.62 62.96 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.382 0.611 . . . . 0.0 110.407 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.552 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.8 tm? -71.45 -44.61 64.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.721 177.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.819 ' HB2' HG23 ' A' ' 2' ' ' THR . 43.8 t -60.01 -30.72 69.33 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.969 174.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -76.83 -31.52 56.95 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.456 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' HB2' HG13 ' A' ' 35' ' ' ILE . 0.5 OUTLIER -65.36 -38.94 91.58 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.608 HD13 HD13 ' A' ' 28' ' ' LEU . 54.8 mt -57.58 -49.86 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.174 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 48.6 mt-10 -58.98 -26.08 64.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.704 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.408 ' C ' HD21 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -64.89 -49.11 71.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.974 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.651 HD12 ' HZ1' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -82.73 -23.67 33.92 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.23 177.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 26.0 mmm -54.3 -42.52 70.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.8 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -64.91 -12.49 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.63 HE21 ' HA ' ' A' ' 14' ' ' LEU . 49.3 mt-30 -77.63 -15.11 59.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.048 0.452 . . . . 0.0 110.198 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.01 2.2 30.09 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.083 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -62.61 165.64 6.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.018 0.437 . . . . 0.0 111.227 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m -111.09 132.1 54.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.702 -173.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.7 p90 -63.73 -23.66 67.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.597 -172.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.474 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.6 pt20 -59.9 -53.75 54.22 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.955 0.407 . . . . 0.0 111.056 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.474 ' H ' ' HG3' ' A' ' 22' ' ' GLN . 5.3 m-20 -79.56 -25.13 41.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.714 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.72 HG13 HD11 ' A' ' 42' ' ' LEU . 38.9 mt -59.64 -49.28 84.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 109.897 171.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.689 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.7 tt0 -63.86 -35.58 81.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.696 ' O ' HG21 ' A' ' 29' ' ' VAL . 32.8 ttmt -58.76 -48.74 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.289 175.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.432 ' O ' HG22 ' A' ' 30' ' ' ILE . . . -55.64 -40.96 72.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.119 177.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.9 mt -63.35 -38.92 93.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.24 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.696 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.88 -30.88 49.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.256 -175.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.587 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -29.11 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.499 0.666 . . . . 0.0 109.396 177.348 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.638 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -89.82 10.5 23.36 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.349 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 44.82 45.02 8.2 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.525 0.678 . . . . 0.0 110.295 -174.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.58 40.51 15.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.998 1.319 . . . . 0.0 112.601 -173.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 9.1 m-20 -76.93 130.68 37.86 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.735 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.631 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.1 tt -57.02 -53.69 39.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.199 1.0 . . . . 0.0 110.195 177.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.631 ' H ' HG22 ' A' ' 35' ' ' ILE . 9.8 pt-20 -68.28 -44.92 74.45 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.939 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.638 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 15.5 tpt -73.26 -32.95 65.0 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.275 -172.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 34' ' ' ASN . . . -67.51 -52.93 33.25 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.651 ' HZ1' HD12 ' A' ' 14' ' ' LEU . 2.2 ptpm? -64.02 -29.33 70.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.788 0.328 . . . . 0.0 110.432 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.494 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 41.1 m-20 -70.19 -36.87 74.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.281 175.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.587 HG13 HD13 ' A' ' 30' ' ' ILE . 14.8 mm -67.82 -38.87 80.9 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.552 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.72 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -59.35 -45.26 91.88 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.572 -0.851 . . . . 0.0 109.197 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -42.12 70.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.677 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 21.2 mm-40 -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.323 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.536 ' HB3' HG12 ' A' ' 46' ' ' VAL . 3.6 t80 -99.31 -75.67 0.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.765 0.793 . . . . 0.0 112.607 -166.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.536 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -98.33 142.06 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.575 -163.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 72.4 p -114.6 171.25 7.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.631 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.81 112.56 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.052 0.453 . . . . 0.0 111.23 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.3 t -153.69 34.28 0.45 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.79 0.805 . . . . 0.0 109.734 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 29.4 m -119.66 134.1 23.86 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.448 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 3.4 Cg_exo -76.3 -171.56 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.912 2.408 . . . . 0.0 111.911 177.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -32.59 72.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.006 0.431 . . . . 0.0 111.092 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.405 ' HB3' ' H ' ' A' ' 54' ' ' VAL . 66.1 m170 -83.06 -149.53 0.09 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.894 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.405 ' H ' ' HB3' ' A' ' 53' ' ' HIS . 42.0 t 70.48 76.45 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.466 0.65 . . . . 0.0 109.886 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -104.67 164.05 12.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.089 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.178 -179.79 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 121.131 0.491 . . . . 0.0 110.162 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.8 m -72.9 -60.56 2.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.68 134.96 7.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.481 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.645 ' O ' ' HG3' ' A' ' 6' ' ' GLN . 16.1 m -91.3 136.56 26.91 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.762 177.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 4' ' ' SER . 1.7 Cg_endo -46.36 84.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.269 3.979 . . . . 0.0 112.885 173.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.645 ' HG3' ' O ' ' A' ' 4' ' ' SER . 48.8 mt-30 -86.79 -47.24 9.25 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.974 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.522 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.2 tm? -64.26 -44.95 90.19 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.764 ' HA ' HD13 ' A' ' 11' ' ' ILE . 47.0 t -65.62 -24.11 66.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.172 175.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.6 t -72.24 -32.25 66.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.231 175.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 6' ' ' GLN . 56.6 mm-40 -60.1 -45.15 93.89 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.7 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.764 HD13 ' HA ' ' A' ' 8' ' ' SER . 82.5 mt -51.74 -48.82 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.83 172.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 13.4 mm-40 -62.4 -24.59 67.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.24 -178.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -67.43 -50.42 59.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.343 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.623 ' H ' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.42 -23.4 50.61 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.686 178.325 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.544 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 20.3 mmm -56.67 -38.17 71.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.626 170.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.7 t -69.49 -10.01 56.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.579 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -88.95 -15.78 33.41 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.9 -7.93 21.65 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.572 177.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.503 ' HB3' HD13 ' A' ' 42' ' ' LEU . 24.8 m-85 -56.13 156.58 5.4 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -174.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.5 m -99.04 137.19 37.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.573 -173.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.583 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 33.7 m-85 -59.61 -33.0 70.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.282 -177.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -55.11 -50.81 68.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 111.105 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.423 ' HB3' HG13 ' A' ' 46' ' ' VAL . 8.6 m-20 -79.73 -27.37 40.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.401 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.622 HG13 HD11 ' A' ' 42' ' ' LEU . 40.9 mt -56.3 -49.11 78.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.738 0.304 . . . . 0.0 110.448 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.664 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.03 -38.1 87.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.15 0.5 . . . . 0.0 109.685 176.746 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.68 ' O ' HG23 ' A' ' 29' ' ' VAL . 29.5 ttmt -57.7 -45.88 85.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.926 176.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.577 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -59.3 -41.1 88.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.028 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 25' ' ' GLN . 30.7 mt -64.84 -38.44 90.97 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.637 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -66.61 -32.33 57.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.481 -176.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.536 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -31.86 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.615 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -87.53 9.08 22.21 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.227 -177.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.587 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.8 pm0 43.1 49.58 5.48 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.191 0.52 . . . . 0.0 110.302 -174.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 46.07 39.71 6.2 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.813 1.245 . . . . 0.0 112.694 -174.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.587 ' ND2' HE21 ' A' ' 32' ' ' GLN . 35.6 m-20 -72.07 156.26 39.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.096 175.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.711 HG22 ' H ' ' A' ' 36' ' ' GLU . 2.1 tt -67.53 -68.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.27 0.557 . . . . 0.0 110.979 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.711 ' H ' HG22 ' A' ' 35' ' ' ILE . 40.0 mt-10 -76.07 -37.43 58.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.764 -174.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.615 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 12.4 tpt -62.3 -38.34 89.03 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.189 -0.605 . . . . 0.0 110.942 -174.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.41 -52.64 37.29 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.5 ptpt -60.98 -31.83 71.41 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.231 0.538 . . . . 0.0 110.698 179.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.49 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 75.1 m-20 -81.58 -28.83 33.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.727 -178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.536 HG13 HD13 ' A' ' 30' ' ' ILE . 9.0 mm -67.19 -39.07 82.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.738 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.251 177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD11 HG13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -61.06 -47.42 86.44 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.28 174.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.49 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 56.1 ttp85 -47.08 -44.2 20.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.52 174.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -77.73 -46.31 22.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.554 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.554 ' HB3' HG12 ' A' ' 46' ' ' VAL . 6.1 t80 -82.71 -64.15 1.23 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.665 0.745 . . . . 0.0 112.365 -167.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.554 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.1 OUTLIER -108.06 145.83 14.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.604 -1.18 . . . . 0.0 112.399 -165.029 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 p -114.26 145.76 41.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.279 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.8 mt -88.79 128.32 41.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.976 -172.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.7 p -89.96 -26.69 20.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.787 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.6 m -87.02 129.77 50.78 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.249 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.48 129.09 9.17 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.51 2.14 . . . . 0.0 112.84 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' A' ' 53' ' ' HIS . . . -74.95 163.25 27.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.668 173.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.562 ' HB2' ' O ' ' A' ' 52' ' ' ALA . 37.3 m80 75.84 136.18 0.06 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.627 0.727 . . . . 0.0 110.791 -174.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.7 t -80.75 -23.3 11.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.462 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.77 138.85 31.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.516 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 36.1 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.722 -0.656 . . . . 0.0 109.925 -179.965 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.499 ' HB2' ' HB2' ' A' ' 8' ' ' SER . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 m -88.68 -2.15 58.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.015 0.436 . . . . 0.0 110.735 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.46 -152.52 0.06 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.126 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.5 m -57.71 126.51 76.19 Favored Pre-proline 0 C--O 1.238 0.459 0 CA-C-O 121.109 0.481 . . . . 0.0 110.605 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -63.18 -34.53 68.28 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.615 2.877 . . . . 0.0 113.673 -169.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.61 ' HA ' ' HB2' ' A' ' 9' ' ' SER . 3.4 pt20 -78.05 -29.37 49.23 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.02 0.438 . . . . 0.0 110.994 -173.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.504 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.6 tm? -64.1 -47.25 80.78 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 173.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 1' ' ' ALA . 34.7 t -63.09 -38.37 90.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.179 175.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.61 ' HB2' ' HA ' ' A' ' 6' ' ' GLN . 58.6 m -65.0 -28.17 69.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.553 174.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.47 ' OE1' HG13 ' A' ' 35' ' ' ILE . 1.4 tp10 -66.91 -42.92 84.6 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.532 ' O ' HD23 ' A' ' 14' ' ' LEU . 2.0 mp -52.26 -42.85 38.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 121.052 0.453 . . . . 0.0 110.515 169.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 36.3 mt-10 -63.82 -24.02 67.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.348 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -70.52 -50.49 37.24 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.158 -178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.657 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -72.48 -23.99 61.11 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.654 176.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.556 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -57.18 -34.29 68.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.072 175.262 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -67.06 -13.06 61.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.743 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.529 HE21 ' HA ' ' A' ' 14' ' ' LEU . 46.4 mt-30 -85.58 -12.22 52.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.649 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.2 -3.59 29.89 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.417 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.515 ' HB3' HD13 ' A' ' 42' ' ' LEU . 20.6 m-85 -58.13 157.99 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.479 0.657 . . . . 0.0 112.474 -174.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.451 ' HB2' ' HG2' ' A' ' 22' ' ' GLN . 1.3 p -95.84 135.19 37.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.667 -175.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.607 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 48.3 p90 -66.57 -26.91 67.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.118 -176.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HG2' ' HB2' ' A' ' 20' ' ' SER . 8.8 pt20 -63.13 -45.91 89.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.713 0.768 . . . . 0.0 109.954 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.513 ' HB3' HG13 ' A' ' 46' ' ' VAL . 20.9 m-20 -81.13 -29.13 34.86 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.485 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.657 HG12 HD21 ' A' ' 14' ' ' LEU . 39.8 mt -57.44 -48.53 82.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.177 173.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.651 ' HA ' HD12 ' A' ' 28' ' ' LEU . 54.3 tt0 -63.07 -39.94 96.21 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.688 ' O ' HG23 ' A' ' 29' ' ' VAL . 36.4 ttmt -53.88 -47.26 71.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.062 176.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.521 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -59.93 -41.79 92.57 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.328 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.651 HD12 ' HA ' ' A' ' 25' ' ' GLN . 31.4 mt -64.95 -36.57 84.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.778 -177.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.0 m -67.1 -30.52 49.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.197 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.728 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.67 -32.92 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-O 121.218 0.533 . . . . 0.0 109.579 174.189 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.597 ' HA ' ' SD ' ' A' ' 37' ' ' MET . . . -82.95 4.3 26.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.765 -177.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.452 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 42.49 43.83 3.3 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.602 0.715 . . . . 0.0 110.768 -172.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 58.1 49.05 12.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.725 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 1.2 m-80 -83.59 163.74 20.18 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 173.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.772 HG22 ' H ' ' A' ' 36' ' ' GLU . 2.8 tt -78.4 -64.22 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 121.606 0.717 . . . . 0.0 109.199 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.772 ' H ' HG22 ' A' ' 35' ' ' ILE . 12.2 pt-20 -76.29 -36.89 58.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.264 -174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.597 ' SD ' ' HA ' ' A' ' 31' ' ' ALA . 38.4 ttm -63.79 -29.66 70.84 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.723 0.297 . . . . 0.0 111.204 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.463 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -77.05 -52.83 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.7 ptpt -60.08 -29.89 68.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.05 0.453 . . . . 0.0 110.637 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -75.16 -36.92 61.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.799 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.728 HG13 HD13 ' A' ' 30' ' ' ILE . 10.6 mm -66.48 -38.6 82.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.047 177.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.596 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.66 -49.07 78.9 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.185 174.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.64 -45.77 66.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.477 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.81 -41.21 71.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 111.995 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 6.6 m-85 -93.84 -73.0 0.58 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.48 -170.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.513 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -96.08 139.44 19.17 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.4 -168.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 m -114.44 159.37 20.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.518 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.496 ' HB ' ' H ' ' A' ' 50' ' ' SER . 0.0 OUTLIER -108.0 177.21 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.497 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -86.15 5.33 34.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.489 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.496 ' H ' ' HB ' ' A' ' 48' ' ' ILE . 49.3 m -74.19 132.78 78.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.363 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.413 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 45.1 Cg_endo -67.39 -168.9 0.19 Allowed 'Trans proline' 0 C--O 1.235 0.375 0 C-N-CA 123.306 2.671 . . . . 0.0 113.088 -176.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 51' ' ' PRO . . . 75.1 -56.54 0.62 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.516 0.726 . . . . 0.0 110.222 -174.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -98.4 81.25 2.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.8 -42.39 14.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.682 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -172.81 126.91 0.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.026 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.122 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.351 179.04 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 110.49 -0.189 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.5 m -73.62 -41.97 62.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.44 0.638 . . . . 0.0 109.519 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.86 139.72 53.69 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.244 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.606 ' HB2' ' HB2' ' A' ' 8' ' ' SER . 26.6 p -61.57 123.99 79.15 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 121.14 0.495 . . . . 0.0 110.783 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.555 ' HG2' ' OE1' ' A' ' 6' ' ' GLN . 26.9 Cg_endo -93.43 -111.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.079 2.52 . . . . 0.0 115.076 -174.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.555 ' OE1' ' HG2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -78.45 -36.9 44.81 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.108 -163.536 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.573 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.6 tm? -59.78 -43.21 94.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.65 ' HA ' HD13 ' A' ' 11' ' ' ILE . 47.7 t -65.71 -32.17 73.57 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.943 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.549 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 74.1 m -63.78 -32.35 73.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.542 176.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.1 mm-40 -64.38 -48.31 75.93 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.65 HD13 ' HA ' ' A' ' 8' ' ' SER . 69.9 mt -52.84 -51.15 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.46 171.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.664 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -57.53 -27.51 62.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.771 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 3.0 t-20 -60.81 -50.65 72.59 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.544 0.211 . . . . 0.0 110.745 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.918 ' HA ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -83.96 -24.42 30.66 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 119.166 -1.013 . . . . 0.0 110.946 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.664 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.11 -39.69 87.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.91 175.587 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -66.07 -17.4 64.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.044 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.918 HE21 ' HA ' ' A' ' 14' ' ' LEU . 40.7 mt-30 -80.43 -16.82 53.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.964 0.412 . . . . 0.0 110.951 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.72 -2.18 24.61 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.316 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.475 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.3 m-85 -59.08 166.96 1.85 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.17 0.509 . . . . 0.0 111.739 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -104.71 133.98 48.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.992 -172.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.584 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 31.5 p90 -65.16 -28.57 69.5 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.927 -170.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -62.23 -52.14 64.96 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.008 0.432 . . . . 0.0 110.878 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.596 ' HB3' HG13 ' A' ' 46' ' ' VAL . 6.4 m-20 -74.74 -25.01 58.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.352 177.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.66 HG13 HD11 ' A' ' 42' ' ' LEU . 42.1 mt -60.66 -49.5 84.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.002 0.429 . . . . 0.0 110.05 173.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.7 ' HA ' HD12 ' A' ' 28' ' ' LEU . 29.6 tt0 -63.9 -37.31 86.91 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.381 176.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.677 ' O ' HG21 ' A' ' 29' ' ' VAL . 37.4 ttmt -54.66 -50.61 67.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.035 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.497 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -56.64 -41.1 76.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.087 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.7 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.0 mt -63.95 -37.93 89.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.677 HG21 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -68.97 -30.41 46.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.06 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.658 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.61 -27.42 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.139 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.579 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -91.33 10.68 26.4 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.768 -176.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 2.7 pm0 43.15 46.91 5.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.275 0.56 . . . . 0.0 110.639 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 51.61 33.2 10.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.224 1.41 . . . . 0.0 113.277 -176.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.409 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 11.7 m-20 -70.99 149.69 46.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.339 174.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.646 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.2 tt -65.77 -59.69 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-O 121.605 0.716 . . . . 0.0 110.4 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.646 ' H ' HG22 ' A' ' 35' ' ' ILE . 12.3 pt-20 -75.53 -40.48 56.9 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.982 -172.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.579 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 43.0 tpp -67.71 -32.79 73.67 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.886 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -68.54 -51.92 37.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.893 0.377 . . . . 0.0 111.808 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 18.7 ptpt -62.65 -29.24 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.638 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -77.08 -39.9 48.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.658 HG13 HD13 ' A' ' 30' ' ' ILE . 11.9 mm -63.74 -38.79 83.23 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.402 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.66 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -60.29 -48.5 81.46 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.083 173.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -40.9 65.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.667 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.94 -31.99 57.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.028 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.485 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 11.4 m-85 -106.48 -80.56 0.56 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.18 135.27 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.164 -170.819 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.4 p -113.51 165.79 12.14 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.648 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -98.5 134.69 36.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.777 -174.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 t -86.64 -5.09 59.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.166 0.507 . . . . 0.0 110.031 177.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -72.04 140.97 83.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.593 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.49 99.48 0.83 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.82 2.347 . . . . 0.0 112.066 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -112.76 160.51 17.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.439 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -120.48 9.58 10.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.041 177.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.02 134.67 40.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.54 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -152.04 79.92 1.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.909 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.133 -0.937 . . . . 0.0 110.237 -176.728 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.149 0.5 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 19.1 m -85.63 66.08 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.511 0.672 . . . . 0.0 110.062 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.3 -78.87 0.52 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.242 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.401 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 19.4 m -118.85 126.06 27.34 Favored Pre-proline 0 N--CA 1.445 -0.677 0 CA-C-O 120.8 0.333 . . . . 0.0 111.115 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 12.9 Cg_exo -73.11 -8.63 22.41 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.123 2.549 . . . . 0.0 111.528 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.523 ' O ' ' HB3' ' A' ' 9' ' ' SER . 47.3 mt-30 -75.61 -39.68 57.56 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.219 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.529 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.4 tm? -67.99 -42.68 80.42 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.524 ' HA ' HD11 ' A' ' 11' ' ' ILE . 38.6 t -65.69 -24.67 67.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.193 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.1 t -70.0 -30.83 68.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.534 175.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 73.2 mm-40 -58.75 -46.87 86.47 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.524 HD11 ' HA ' ' A' ' 8' ' ' SER . 3.0 mp -53.09 -50.34 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.779 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.562 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 5.7 mm-40 -61.85 -24.68 67.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.665 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.525 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 9.6 t-20 -63.87 -50.9 67.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.623 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -80.22 -22.91 41.32 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.956 179.119 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.564 ' N ' HD22 ' A' ' 14' ' ' LEU . 12.9 mmm -56.58 -38.0 71.38 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.632 171.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -64.79 -12.09 43.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.724 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -92.26 -14.98 28.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.606 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.77 -5.04 22.65 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.73 176.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.738 ' HB3' HD13 ' A' ' 42' ' ' LEU . 41.9 m-85 -59.57 163.77 3.98 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 111.686 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 24' ' ' ILE . 53.4 m -108.78 136.3 48.58 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -171.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.546 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.6 m-85 -57.56 -36.97 72.36 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.638 -174.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.93 -50.17 69.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.919 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.764 ' HB3' HG13 ' A' ' 46' ' ' VAL . 6.5 m-20 -81.82 -23.12 36.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.546 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 42.2 mt -58.19 -49.83 80.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.794 0.33 . . . . 0.0 110.188 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.694 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.8 tt0 -62.39 -38.17 88.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.342 0.592 . . . . 0.0 109.626 176.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 20.8 mtpp -58.64 -38.89 79.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.058 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.477 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -66.37 -38.96 88.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.523 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.694 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.7 mt -64.11 -37.24 86.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.521 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 26' ' ' LYS . 5.1 m -68.53 -30.89 48.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.344 -177.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.687 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.57 -29.12 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.718 0.771 . . . . 0.0 109.708 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.639 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -88.17 8.44 27.0 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.993 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 40.43 52.0 2.9 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.531 0.681 . . . . 0.0 111.008 -172.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 47.01 44.71 15.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.982 1.313 . . . . 0.0 112.613 -174.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 7.9 m-20 -79.38 154.87 28.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.05 175.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.726 HG22 ' H ' ' A' ' 36' ' ' GLU . 2.0 tt -65.56 -70.6 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.782 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.726 ' H ' HG22 ' A' ' 35' ' ' ILE . 47.6 mm-40 -75.35 -36.89 60.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.618 -173.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.639 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 14.4 tpt -63.02 -36.3 83.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.225 -174.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.36 -52.61 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.921 0.391 . . . . 0.0 111.825 178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.5 ptpt -62.93 -29.67 70.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.927 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.6 m-20 -78.32 -32.53 49.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.328 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.687 HG13 HD13 ' A' ' 30' ' ' ILE . 13.0 mm -67.4 -38.51 80.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.199 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.738 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -58.09 -54.14 50.31 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.434 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 46.8 ttt180 -44.9 -52.82 8.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.563 175.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.87 -44.71 84.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.774 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 20.7 m-85 -99.94 -80.68 0.47 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -85.61 125.91 40.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -172.505 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.2 p -100.28 174.35 6.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.64 -178.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.92 105.44 16.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.611 -177.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.0 m -97.58 4.4 50.27 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.924 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 m -119.22 126.82 26.82 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.757 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.59 -28.12 3.68 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.387 2.058 . . . . 0.0 110.532 168.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -152.47 92.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.511 -1.222 . . . . 0.0 108.425 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -70.92 123.12 21.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.338 -173.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.81 119.81 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.553 0.692 . . . . 0.0 111.282 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -115.74 97.79 6.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.08 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.0 p . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.542 179.659 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 120.957 0.408 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.5 p -85.24 -68.76 0.7 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.285 0.564 . . . . 0.0 110.593 177.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -159.62 156.09 27.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.954 178.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.2 t -75.52 125.21 88.94 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 121.012 0.435 . . . . 0.0 110.538 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.99 -19.92 34.4 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.973 2.449 . . . . 0.0 111.732 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 9' ' ' SER . 78.3 mt-30 -83.71 -42.37 16.66 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.66 178.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.608 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.5 tm? -63.36 -49.27 74.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.08 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.739 ' HA ' HD13 ' A' ' 11' ' ' ILE . 30.6 t -56.67 -35.71 68.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 174.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.6 t -63.98 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.498 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 35' ' ' ILE . 2.8 mm-40 -63.48 -48.05 79.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 176.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.739 HD13 ' HA ' ' A' ' 8' ' ' SER . 14.5 mt -59.96 -49.85 82.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.118 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.646 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.1 mt-10 -63.06 -25.19 68.26 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.675 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -62.36 -51.29 68.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.456 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.663 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.19 -24.03 35.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.64 176.605 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.826 ' HE2' ' HB3' ' A' ' 21' ' ' TYR . 1.2 mmt -54.12 -29.0 43.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.785 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 t -75.5 -9.69 58.8 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.186 0.517 . . . . 0.0 110.438 -169.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.641 HE21 ' HA ' ' A' ' 14' ' ' LEU . 2.3 mp0 -80.88 -23.82 38.75 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.301 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.46 4.8 21.61 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.291 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.406 ' HB3' HD13 ' A' ' 42' ' ' LEU . 34.7 m-85 -61.96 167.79 3.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.054 0.454 . . . . 0.0 111.186 -177.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.8 m -104.14 130.71 51.88 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.336 -170.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.826 ' HB3' ' HE2' ' A' ' 15' ' ' MET . 10.9 p90 -67.09 -23.64 65.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.519 -170.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.52 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -59.82 -53.9 52.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.083 0.468 . . . . 0.0 110.578 177.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.695 ' HB3' HG13 ' A' ' 46' ' ' VAL . 1.5 m-20 -82.93 -23.83 33.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.497 -179.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.609 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 24.3 mt -59.86 -50.2 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.644 0.259 . . . . 0.0 110.381 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.734 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.5 tt0 -65.11 -34.73 79.09 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.674 ' O ' HG23 ' A' ' 29' ' ' VAL . 8.0 ttpp -61.34 -40.28 93.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.12 177.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.457 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -63.23 -39.59 95.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.687 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.734 HD12 ' HA ' ' A' ' 25' ' ' GLN . 35.7 mt -64.93 -36.59 84.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.494 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.674 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.6 m -69.33 -30.04 44.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.413 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.744 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.37 -31.24 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -88.39 11.56 16.54 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.53 -177.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? 36.05 43.97 0.23 Allowed 'General case' 0 N--CA 1.474 0.764 0 O-C-N 124.019 0.825 . . . . 0.0 112.316 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.512 ' HB3' HD22 ' A' ' 7' ' ' LEU . 16.0 m120 68.76 29.73 5.09 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.035 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 14.5 m-20 -72.62 151.13 42.48 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 120.999 0.428 . . . . 0.0 110.603 171.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.752 HG22 ' H ' ' A' ' 36' ' ' GLU . 11.8 tt -72.79 -53.1 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.363 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.752 ' H ' HG22 ' A' ' 35' ' ' ILE . 19.2 mt-10 -75.62 -45.26 38.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.98 -175.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.618 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 17.4 tpt -63.59 -30.16 71.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 -175.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.09 -51.98 12.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.875 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.53 ' HE3' HG12 ' A' ' 35' ' ' ILE . 19.3 ptpt -60.9 -31.16 70.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.002 0.43 . . . . 0.0 110.51 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -69.4 -41.77 75.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.448 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.744 HG13 HD13 ' A' ' 30' ' ' ILE . 14.1 mm -65.83 -38.61 82.6 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.232 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.599 HD11 HG13 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.3 -50.38 73.86 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 172.535 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -53.76 -36.66 62.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.283 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -81.36 -31.09 33.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.015 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.525 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 16.7 m-85 -110.31 -79.8 0.58 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.2 -171.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.695 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -97.18 127.27 49.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.049 -173.304 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -125.55 153.52 43.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.709 -175.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.51 141.87 14.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.023 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.3 t -94.72 18.91 10.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.426 0.631 . . . . 0.0 109.568 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.494 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 24.6 t -118.9 129.41 25.41 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.362 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 12.6 Cg_exo -71.37 -12.0 29.18 Favored 'Trans proline' 0 C--O 1.234 0.307 0 C-N-CA 122.779 2.319 . . . . 0.0 112.586 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 69.15 -56.59 0.54 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.665 0.786 . . . . 0.0 112.055 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -74.44 -48.44 27.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.084 0.468 . . . . 0.0 109.947 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 62.4 t -73.48 111.69 8.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.689 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -108.86 -12.16 14.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.471 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.258 178.485 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.5 m 58.44 46.39 15.21 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 110.476 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -162.03 88.68 0.69 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.62 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.5 t -88.0 127.2 58.5 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.983 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.19 -23.41 33.4 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.771 2.314 . . . . 0.0 111.149 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 9' ' ' SER . 93.8 mt-30 -78.72 -37.33 41.75 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.834 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.553 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.0 tm? -63.68 -45.8 88.42 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.494 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.4 t -60.11 -35.03 74.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.018 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.2 m -60.98 -29.57 69.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.464 177.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.584 ' HB3' ' HB ' ' A' ' 35' ' ' ILE . 3.5 mm-40 -63.24 -49.47 73.99 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.52 ' O ' HD11 ' A' ' 14' ' ' LEU . 3.7 mp -58.51 -49.3 82.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.42 174.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 50.4 mt-10 -63.51 -24.49 67.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.995 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -61.9 -50.09 73.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.504 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.605 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.15 -23.27 38.39 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.275 178.104 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 22.4 mmm -57.28 -26.39 60.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.787 177.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.6 p -61.41 -22.78 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.956 0.408 . . . . 0.0 111.104 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -79.62 -20.41 46.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.071 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.83 6.16 26.73 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.511 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -60.4 172.88 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.5 m -112.4 134.47 53.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.468 -170.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.431 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 70.3 m-85 -58.54 -35.37 72.21 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.725 -173.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.506 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -56.35 -54.33 46.77 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.557 0.536 . . . . 0.0 111.724 -176.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.657 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 5.9 m-20 -80.74 -23.56 39.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.703 HG13 HD11 ' A' ' 42' ' ' LEU . 23.8 mt -59.12 -50.08 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.919 0.39 . . . . 0.0 110.084 173.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.716 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.9 tt0 -60.8 -40.77 93.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.533 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 16.1 mtpp -57.66 -43.69 85.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.069 175.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -63.37 -42.06 98.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.359 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.716 HD12 ' HA ' ' A' ' 25' ' ' GLN . 39.2 mt -61.83 -37.28 83.87 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.931 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.5 m -69.03 -30.98 48.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.293 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.754 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.88 -30.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.437 0.637 . . . . 0.0 109.349 175.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.633 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -88.3 12.99 12.55 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.422 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 40.35 52.17 2.86 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.875 0.734 . . . . 0.0 110.88 -176.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.52 51.35 15.52 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.449 -1.25 . . . . 0.0 112.856 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 7.9 m-20 -93.48 158.77 15.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.36 174.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.81 HG22 ' H ' ' A' ' 36' ' ' GLU . 6.2 tt -77.44 -60.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.003 176.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.81 ' H ' HG22 ' A' ' 35' ' ' ILE . 3.5 mt-10 -73.49 -43.82 59.26 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.617 -174.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.633 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 16.0 tpt -62.95 -33.98 76.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.35 -175.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.535 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -72.1 -51.95 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.791 176.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.648 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 10.4 ptpt -60.56 -31.22 70.34 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.095 0.474 . . . . 0.0 110.76 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 75.2 m-20 -78.56 -35.08 46.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.577 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.754 HG13 HD13 ' A' ' 30' ' ' ILE . 11.4 mm -67.12 -38.78 81.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.595 174.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.703 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -58.49 -49.07 78.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.161 172.575 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.01 -33.82 62.94 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.197 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 34.7 mm-40 -83.02 -25.87 31.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.957 0.408 . . . . 0.0 112.007 178.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -110.9 -75.17 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.466 0.65 . . . . 0.0 112.17 -171.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.447 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -96.84 146.23 7.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.036 -168.26 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.5 p -118.06 171.33 8.16 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.767 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -100.78 144.41 12.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.252 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 45.6 m -92.17 2.63 56.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.582 0.706 . . . . 0.0 109.098 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -110.01 127.66 26.7 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.408 175.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -68.48 -47.69 1.39 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.951 2.434 . . . . 0.0 111.921 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 46.21 41.73 9.15 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.604 0.565 . . . . 0.0 111.539 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -97.23 -47.52 5.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.976 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 29.7 m -105.69 23.42 2.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.317 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.14 11.61 18.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.018 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.143 -0.932 . . . . 0.0 109.361 -179.756 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.75 0.31 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.4 t -103.65 47.14 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.847 0.832 . . . . 0.0 110.276 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.84 167.18 26.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.147 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 m -78.03 125.67 84.95 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 121.023 0.439 . . . . 0.0 110.145 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.81 -27.47 51.74 Favored 'Trans proline' 0 C--O 1.221 -0.37 0 C-N-CA 123.336 2.691 . . . . 0.0 112.47 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 9' ' ' SER . 4.2 pt20 -70.47 -33.68 71.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.369 0.604 . . . . 0.0 110.593 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.577 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.7 tm? -72.13 -41.81 66.74 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.431 ' O ' ' HG2' ' A' ' 12' ' ' GLU . 43.1 t -62.52 -30.75 71.51 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.16 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 54.9 m -60.85 -31.11 70.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.151 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.915 ' HB3' HD12 ' A' ' 35' ' ' ILE . 18.9 mm-40 -60.69 -49.89 75.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.077 0.465 . . . . 0.0 109.794 172.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.4 ' O ' HD23 ' A' ' 14' ' ' LEU . 2.8 mp -54.15 -46.08 66.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.611 173.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -59.26 -25.31 63.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.594 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 7.0 t-20 -64.04 -51.76 62.62 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.73 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -78.85 -23.49 44.94 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.136 179.159 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.19 -39.47 86.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.352 173.662 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.6 t -69.74 -11.92 61.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.154 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -86.32 -22.5 26.71 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.256 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 122.87 -9.3 9.11 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.054 176.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.884 ' HB3' HD13 ' A' ' 42' ' ' LEU . 50.2 m-85 -61.03 162.49 7.05 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.933 0.397 . . . . 0.0 111.933 -175.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -100.82 133.23 45.6 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.86 -35.96 64.58 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.92 -172.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -62.87 -51.72 65.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 -175.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.743 ' CB ' HG13 ' A' ' 46' ' ' VAL . 12.7 m-20 -79.08 -23.52 44.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.76 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.73 HG12 HD21 ' A' ' 14' ' ' LEU . 34.9 mt -58.69 -50.08 80.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 172.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.724 ' HA ' HD12 ' A' ' 28' ' ' LEU . 18.8 tm0? -62.98 -39.66 95.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.702 ' O ' HG21 ' A' ' 29' ' ' VAL . 43.4 mtpt -57.84 -45.28 86.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.39 175.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.5 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -59.84 -37.59 79.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.83 0.348 . . . . 0.0 110.816 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.2 mt -64.23 -38.59 91.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.872 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.702 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -68.79 -30.96 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.737 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.51 -28.43 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.647 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -91.03 12.22 20.48 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.596 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 2.6 pm0 43.33 47.68 5.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.447 0.641 . . . . 0.0 110.665 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.63 35.97 12.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.265 1.426 . . . . 0.0 113.34 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 9.0 m-20 -77.04 142.23 39.96 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.585 169.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.915 HD12 ' HB3' ' A' ' 10' ' ' GLU . 2.4 tp -68.01 -54.99 18.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-O 121.253 0.549 . . . . 0.0 110.76 174.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.693 ' H ' HG22 ' A' ' 35' ' ' ILE . 25.7 mt-10 -65.75 -48.44 71.87 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.677 -174.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.647 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 53.4 tpp -64.97 -32.31 73.98 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.712 -176.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 34' ' ' ASN . . . -70.5 -51.88 25.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 16.5 ptpt -62.14 -29.05 70.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.107 0.48 . . . . 0.0 110.149 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.2 -39.56 60.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.014 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.737 HG13 HD13 ' A' ' 30' ' ' ILE . 10.5 mm -63.88 -38.87 83.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.356 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.884 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 172.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -54.71 -34.79 62.88 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.482 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -86.21 -27.6 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.878 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 8.0 m-85 -114.76 -79.37 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.187 0.518 . . . . 0.0 111.956 -174.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.743 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -98.02 117.69 43.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.855 -175.154 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.552 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 1.7 p -114.99 -178.37 3.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.502 0.668 . . . . 0.0 111.576 -174.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.04 153.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.225 -173.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.9 t -90.39 51.54 2.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.444 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 25.8 p -74.73 151.15 86.77 Favored Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.047 -175.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 11.9 Cg_exo -71.72 14.99 0.38 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.432 2.755 . . . . 0.0 112.853 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' A' ' 50' ' ' SER . . . -81.02 68.18 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.283 0.563 . . . . 0.0 110.547 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' HB1' ' A' ' 55' ' ' ALA . 10.7 p80 -158.45 158.51 34.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.471 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.8 m -83.25 77.98 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.555 0.693 . . . . 0.0 111.442 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.431 ' HB1' ' CE1' ' A' ' 53' ' ' HIS . . . -80.63 -68.4 0.69 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.436 177.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.8 p . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.589 175.244 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.8 t -134.51 134.3 41.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.332 0.587 . . . . 0.0 111.146 178.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.64 26.73 1.02 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.436 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m -76.05 129.86 79.6 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.57 -178.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.508 ' HB2' ' H ' ' A' ' 6' ' ' GLN . 64.3 Cg_endo -79.06 -136.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.943 2.429 . . . . 0.0 112.704 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.588 ' O ' ' HB2' ' A' ' 9' ' ' SER . 52.4 mt-30 -90.24 -47.17 7.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.421 -170.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.526 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.6 tm? -61.74 -42.1 98.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.11 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -66.93 -24.33 66.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.27 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.588 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 11.7 m -71.07 -31.78 68.28 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.767 176.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.93 -47.19 86.79 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.721 HD13 HD13 ' A' ' 28' ' ' LEU . 87.8 mt -56.19 -53.67 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.755 174.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 11.5 mm-40 -57.21 -25.84 59.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.958 -176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -66.34 -51.09 60.78 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.867 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.708 HD12 ' HZ2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -79.64 -22.65 43.31 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.811 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.537 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 16.6 mmm -53.73 -38.87 64.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.748 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.9 m -71.63 -3.07 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.003 -177.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -87.98 -16.76 32.86 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 -2.68 24.16 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.76 176.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.0 m-85 -61.36 168.57 2.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.191 0.52 . . . . 0.0 111.974 -176.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 24' ' ' ILE . 58.8 m -113.67 136.08 53.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.119 -169.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.0 m-85 -59.55 -34.92 73.27 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.139 -174.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -53.61 -50.59 65.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.018 0.437 . . . . 0.0 111.191 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.527 ' HB3' HG13 ' A' ' 46' ' ' VAL . 23.1 m-20 -82.49 -26.86 32.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.784 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.611 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 41.3 mt -60.17 -49.98 82.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.201 0.524 . . . . 0.0 110.398 174.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.91 -35.49 80.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.961 178.192 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.687 ' O ' HG21 ' A' ' 29' ' ' VAL . 1.5 ttmm -59.04 -45.98 89.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.829 176.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.412 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -58.39 -40.6 82.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.95 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.4 mt -62.19 -40.1 94.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.688 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.687 HG21 ' O ' ' A' ' 26' ' ' LYS . 3.6 m -67.63 -31.53 52.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.264 -175.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.588 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -27.66 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-O 121.726 0.774 . . . . 0.0 109.265 177.035 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.637 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -91.94 13.62 18.07 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.434 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 42.15 43.78 2.95 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.643 0.589 . . . . 0.0 111.527 -175.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 55.25 57.05 5.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.795 -175.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.549 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 3.7 t-20 -90.26 154.13 19.96 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.494 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.705 HG22 ' H ' ' A' ' 36' ' ' GLU . 1.6 tt -67.3 -64.92 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.913 169.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.705 ' H ' HG22 ' A' ' 35' ' ' ILE . 26.8 mt-10 -71.64 -49.78 36.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.309 -175.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.797 ' HA ' ' HE3' ' A' ' 37' ' ' MET . 3.2 tpt -62.22 -34.58 76.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.342 -168.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -69.68 -52.73 23.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.799 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.708 ' HZ2' HD12 ' A' ' 14' ' ' LEU . 1.4 ptpm? -66.01 -29.03 69.33 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.773 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 89.4 m-20 -76.14 -32.64 59.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.205 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.588 HG13 HD13 ' A' ' 30' ' ' ILE . 10.8 mm -68.01 -38.41 79.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.186 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.663 ' HA ' HG11 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -57.04 -51.39 69.48 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 172.14 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 21.9 ttp180 -48.45 -48.96 37.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.89 175.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 43.8 mt-10 -77.78 -24.34 48.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.862 -175.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.549 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 10.2 m-85 -116.16 -75.92 0.58 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -171.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.663 HG11 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -86.37 138.3 19.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.383 -170.567 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -105.58 174.57 5.82 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.433 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -95.55 126.18 48.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 120.895 0.378 . . . . 0.0 111.772 -172.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -72.15 -18.12 61.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -74.8 139.52 73.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.692 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.63 48.47 1.61 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.88 2.387 . . . . 0.0 112.283 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.21 111.35 9.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.698 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -84.13 155.15 22.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.237 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.5 m -94.67 28.95 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.216 0.531 . . . . 0.0 111.317 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.3 87.38 2.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.305 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.341 -178.03 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.003 0 CA-C-O 120.486 0.184 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.8 m 64.77 54.75 1.32 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.75 0.786 . . . . 0.0 110.026 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -135.98 158.41 44.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.849 178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.6 m -59.05 138.71 87.79 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.235 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.482 ' O ' ' HB3' ' A' ' 8' ' ' SER . 17.5 Cg_endo -57.73 -8.82 4.71 Favored 'Trans proline' 0 N--CA 1.476 0.454 0 C-N-CA 123.579 2.853 . . . . 0.0 113.488 -178.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.582 ' O ' ' HB2' ' A' ' 9' ' ' SER . 22.9 mt-30 -71.68 -24.24 61.79 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.576 0.703 . . . . 0.0 110.361 174.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.576 ' O ' HD12 ' A' ' 7' ' ' LEU . 2.3 tm? -69.66 -39.06 77.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 170.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.573 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 45.6 t -63.75 -26.68 68.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.807 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.582 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 73.4 m -69.39 -30.79 68.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.999 173.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.591 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 4.2 mm-40 -63.0 -34.61 77.92 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.573 ' HB ' ' O ' ' A' ' 8' ' ' SER . 51.2 mt -55.03 -48.62 75.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.895 171.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.673 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 44.3 mt-10 -58.16 -25.85 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.012 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.591 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -64.55 -48.05 76.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.176 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.64 ' H ' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.06 -24.28 32.8 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.669 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.673 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 23.9 mmm -55.15 -45.6 75.68 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.913 176.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.4 p -68.81 -3.53 12.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.996 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -88.22 -12.88 42.49 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.192 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.69 -8.06 22.02 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.192 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.812 ' HB3' HD11 ' A' ' 42' ' ' LEU . 37.3 m-85 -61.75 157.22 18.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.124 0.488 . . . . 0.0 111.183 -176.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.2 m -100.87 129.51 46.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.338 0.59 . . . . 0.0 111.619 -171.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.677 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.2 p90 -60.71 -26.4 67.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.231 -174.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -59.14 -51.62 69.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.074 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.648 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -82.28 -22.61 35.66 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.024 177.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.677 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 39.6 mt -57.76 -50.24 78.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.83 0.348 . . . . 0.0 110.674 174.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.741 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.5 tt0 -61.85 -38.35 87.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.607 0.717 . . . . 0.0 109.529 176.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.655 ' O ' HG21 ' A' ' 29' ' ' VAL . 34.4 mtpt -61.4 -40.11 93.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.214 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.407 ' O ' HG22 ' A' ' 30' ' ' ILE . . . -65.27 -38.06 89.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.89 176.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.741 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.9 mt -63.56 -36.27 83.23 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.651 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.655 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -70.04 -30.76 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.102 -177.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.639 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -26.62 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.401 0.619 . . . . 0.0 109.486 175.523 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.602 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -92.27 10.79 28.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.587 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.5 pm0 43.54 47.18 6.16 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.248 0.546 . . . . 0.0 110.676 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 47.4 43.23 15.23 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.788 1.235 . . . . 0.0 112.89 -174.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.587 ' ND2' HE21 ' A' ' 32' ' ' GLN . 81.2 m-20 -81.68 136.69 35.49 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.61 170.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.599 HG22 ' HG3' ' A' ' 36' ' ' GLU . 4.7 tt -61.31 -48.03 90.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.805 176.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.599 ' HG3' HG22 ' A' ' 35' ' ' ILE . 27.0 mt-10 -72.86 -49.72 28.34 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.134 -174.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.602 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 59.6 tpp -67.43 -34.21 76.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.227 -172.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.79 -51.95 59.48 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -62.51 -29.9 70.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.98 0.419 . . . . 0.0 110.502 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -77.58 -37.12 51.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.639 HG13 HD13 ' A' ' 30' ' ' ILE . 15.4 mm -65.54 -37.82 80.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.544 177.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.812 HD11 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -55.43 -57.72 10.71 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.12 -41.16 16.9 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.292 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.02 -38.87 31.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 17.9 m-85 -101.23 -71.58 0.71 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.334 0.588 . . . . 0.0 112.229 -171.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.785 HG11 ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -92.09 134.82 29.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.213 -170.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.8 m -104.68 164.25 11.9 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.971 -175.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.455 HD12 HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -98.1 -159.6 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.641 178.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.1 t 61.63 38.42 15.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -170.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.519 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 25.1 m -60.9 130.67 91.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.737 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.519 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 2.5 Cg_endo -80.65 174.87 10.65 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.26 2.64 . . . . 0.0 112.771 -174.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 65.75 -86.53 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.351 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.59 ' CE1' ' HB1' ' A' ' 55' ' ' ALA . 41.1 t-80 -145.6 131.91 19.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.747 -171.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.0 t -124.03 -43.8 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.783 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.59 ' HB1' ' CE1' ' A' ' 53' ' ' HIS . . . 57.87 69.96 0.69 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 0.0 112.262 178.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 C--O 1.252 1.198 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.892 176.368 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 120.844 0.354 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 21.8 m -83.29 -41.98 17.68 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.777 -177.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.85 68.24 5.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.153 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 p -64.79 126.97 92.08 Favored Pre-proline 0 N--CA 1.447 -0.623 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.543 -176.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.36 -27.53 47.45 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.154 2.569 . . . . 0.0 112.55 -178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 9' ' ' SER . 23.9 mt-30 -72.09 -44.09 63.78 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.272 0.558 . . . . 0.0 110.015 -177.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.552 HD22 ' C ' ' A' ' 7' ' ' LEU . 4.7 tt -60.8 -47.99 83.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.946 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 39.9 t -57.95 -35.26 70.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.492 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.6 m -66.36 -31.96 73.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.507 177.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 6' ' ' GLN . 2.1 mm-40 -62.08 -45.55 93.03 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.75 -48.99 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.65 174.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.589 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 46.6 mt-10 -61.15 -26.54 67.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -62.95 -50.37 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.818 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.615 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.02 -23.03 36.16 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.055 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.589 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 10.1 mmm -56.24 -45.73 79.86 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.036 175.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.8 p -72.45 -2.51 19.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.071 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -85.12 -19.06 32.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.29 -3.52 18.41 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.654 177.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.602 ' HB3' HD13 ' A' ' 42' ' ' LEU . 45.2 m-85 -64.13 168.76 5.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.008 0.432 . . . . 0.0 111.383 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.9 m -105.95 131.03 53.74 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.262 0.553 . . . . 0.0 111.935 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.541 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.2 p90 -61.46 -30.58 70.69 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.945 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.465 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 22.5 pt20 -56.89 -52.96 63.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.962 0.411 . . . . 0.0 110.981 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.701 ' CB ' HG13 ' A' ' 46' ' ' VAL . 9.2 m-20 -80.87 -23.15 39.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.541 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 54.0 mt -59.26 -50.21 80.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.713 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -66.02 -34.54 78.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.787 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 40.9 mtpt -59.86 -46.35 89.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.985 174.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -58.74 -38.21 77.91 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.196 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.713 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.3 mt -63.57 -37.52 87.63 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -69.65 -30.37 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.14 -177.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.78 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.54 -28.08 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-O 121.448 0.642 . . . . 0.0 109.335 176.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -92.88 11.99 25.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.565 -176.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 41.85 47.89 3.72 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.456 0.646 . . . . 0.0 110.458 -174.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.488 ' ND2' HD11 ' A' ' 7' ' ' LEU . 2.4 p-10 48.32 40.24 14.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.923 1.289 . . . . 0.0 113.165 -175.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -74.65 148.87 40.27 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.393 171.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.725 HG22 ' H ' ' A' ' 36' ' ' GLU . 3.5 tt -65.33 -59.66 3.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.25 0.548 . . . . 0.0 110.979 173.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.725 ' H ' HG22 ' A' ' 35' ' ' ILE . 44.7 mt-10 -71.3 -45.96 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.015 -173.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.648 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 15.6 tpt -64.92 -33.22 75.5 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.912 -172.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -68.76 -52.42 30.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.725 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 0.4 OUTLIER -63.81 -29.98 71.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.095 0.474 . . . . 0.0 110.635 179.002 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -75.56 -35.15 60.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.622 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.78 HG13 HD13 ' A' ' 30' ' ' ILE . 12.6 mm -65.48 -38.32 82.18 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.449 175.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.602 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.32 -54.51 45.93 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 171.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 tmm_? -52.93 -40.32 63.52 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.91 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.97 -44.31 61.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 111.966 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 29.2 m-85 -100.38 -80.55 0.48 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.67 -172.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.701 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.82 122.03 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.111 -172.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.8 m -112.45 168.5 9.59 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.553 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -87.11 125.33 40.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.096 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.8 m -101.77 13.72 34.05 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.562 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 51' ' ' PRO . 55.6 p -105.59 170.23 6.13 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.215 -178.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 50' ' ' SER . 4.9 Cg_endo -49.0 -52.2 9.17 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.691 2.261 . . . . 0.0 111.801 174.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.63 -156.11 0.27 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.837 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 76.6 m80 69.23 26.1 5.51 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.5 t -90.24 63.27 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.706 0.765 . . . . 0.0 109.262 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -105.86 56.69 0.67 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.904 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.0 m . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.391 -178.62 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 120.713 0.292 . . . . 0.0 110.613 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 p -79.54 51.78 1.3 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.043 -177.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.63 23.37 9.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.817 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -69.57 127.37 92.74 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.135 -177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.28 -20.12 66.42 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.047 2.498 . . . . 0.0 111.646 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.68 ' HA ' HE21 ' A' ' 6' ' ' GLN . 0.0 OUTLIER -69.92 -35.44 74.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.201 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.551 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.0 tm? -68.46 -42.64 78.46 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.1 t -62.49 -29.66 70.7 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.093 175.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.2 m -67.59 -30.95 70.68 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.531 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.17 -46.13 90.32 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.0 mp -54.17 -51.55 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.506 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.648 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 63.6 mm-40 -58.84 -26.25 63.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.651 -178.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -62.78 -50.85 69.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.414 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.87 -23.84 36.1 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.25 177.629 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.648 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -56.21 -32.48 64.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.941 176.542 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 t -59.35 -22.59 61.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.824 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -78.99 -21.53 46.9 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.245 -179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.79 1.65 22.69 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.744 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.455 ' O ' ' HE2' ' A' ' 15' ' ' MET . 30.9 m-85 -57.62 167.4 1.08 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 112.305 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 p -99.25 135.22 40.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.333 -173.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.455 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 7.5 m-85 -62.7 -31.83 72.81 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.17 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 7.3 pt20 -62.17 -48.43 80.12 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.609 0.719 . . . . 0.0 110.504 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.772 ' HB3' HG13 ' A' ' 46' ' ' VAL . 40.4 m-20 -82.75 -29.01 30.02 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.456 -177.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.531 HG13 HD11 ' A' ' 42' ' ' LEU . 23.1 mt -57.14 -49.11 80.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.026 172.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.3 tt0 -62.49 -39.83 94.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.914 176.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.64 ' O ' HG22 ' A' ' 29' ' ' VAL . 3.2 ttmm -55.63 -42.94 75.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.958 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.461 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -63.99 -41.6 97.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.957 178.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 25' ' ' GLN . 28.6 mt -63.62 -40.23 96.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.463 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.64 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.8 m -64.86 -31.21 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.211 -176.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.657 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.97 -32.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.334 0.588 . . . . 0.0 109.58 175.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -85.47 8.68 18.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.234 -177.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 44.65 40.49 4.14 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.755 0.659 . . . . 0.0 110.999 -175.321 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 61.82 55.32 2.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.38 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.441 ' HB2' ' HB3' ' A' ' 31' ' ' ALA . 9.9 m-20 -103.05 145.0 30.55 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.685 175.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.716 HG22 ' H ' ' A' ' 36' ' ' GLU . 4.3 tt -62.6 -57.8 10.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.836 0.35 . . . . 0.0 111.384 176.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.716 ' H ' HG22 ' A' ' 35' ' ' ILE . 43.8 mt-10 -68.58 -50.87 48.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.516 -176.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.648 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 15.7 tpt -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.243 -170.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -71.53 -52.19 19.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.771 0.319 . . . . 0.0 111.822 177.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 1.2 ptpm? -63.89 -28.99 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.907 0.384 . . . . 0.0 110.287 179.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.541 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 97.5 m-20 -76.36 -31.01 57.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.903 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.657 HG13 HD13 ' A' ' 30' ' ' ILE . 13.6 mm -70.57 -38.32 73.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.875 174.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.531 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -60.39 -48.51 81.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 170.88 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.541 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 8.7 tpm_? -46.02 -48.91 16.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.287 175.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 33.7 mm-40 -74.72 -43.95 52.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.517 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 23.0 m-85 -97.88 -74.92 0.56 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.592 0.711 . . . . 0.0 112.516 -170.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.772 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -100.44 126.21 54.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.93 -169.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 p -99.21 178.19 4.98 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.207 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -85.05 80.33 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-O 121.913 0.864 . . . . 0.0 109.948 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.7 p -87.7 45.71 1.3 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 114.255 -1.339 . . . . 0.0 112.097 -173.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 47.0 t -107.12 125.21 33.06 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 49.6 Cg_endo -99.42 -1.09 0.87 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.313 2.675 . . . . 0.0 113.008 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 59.75 -167.21 0.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 O-C-N 123.421 0.45 . . . . 0.0 110.014 -174.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -161.29 49.3 0.22 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.23 0.538 . . . . 0.0 110.526 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.42 13.57 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 61.67 20.64 11.5 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.696 -178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.876 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.73 0.3 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.4 m -81.46 130.89 35.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.009 -175.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.81 174.73 0.2 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.437 178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.419 ' HB3' ' HB2' ' A' ' 7' ' ' LEU . 48.0 t -114.29 125.41 29.31 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.378 177.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -67.04 -24.88 44.65 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.831 2.354 . . . . 0.0 111.301 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.456 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 6.3 mm-40 -80.82 -35.58 32.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.779 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.545 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.0 tm? -67.76 -42.92 80.97 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.678 173.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 22.7 t -59.79 -33.76 72.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.853 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 11.5 m -64.24 -30.71 71.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.143 176.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.535 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.3 mm-40 -60.66 -45.96 92.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.2 mp -56.08 -46.29 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.284 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 38.8 mt-10 -59.17 -26.5 64.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.093 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.535 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -63.38 -51.39 66.06 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.675 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -79.91 -23.42 41.81 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 119.196 -1.001 . . . . 0.0 110.165 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.544 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 12.2 mmm -57.94 -35.93 71.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.385 177.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.8 t -73.74 1.23 10.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.657 -177.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -94.24 -18.13 21.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.719 0.295 . . . . 0.0 110.404 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.75 0.35 24.46 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.574 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -63.61 166.99 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.237 0.542 . . . . 0.0 112.192 -176.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -102.01 130.32 48.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.369 -172.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' HA ' HD12 ' A' ' 24' ' ' ILE . 41.1 p90 -62.85 -30.4 71.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.611 -171.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.609 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 1.5 pt20 -64.32 -49.7 70.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.192 0.52 . . . . 0.0 110.629 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.656 ' HB3' HG13 ' A' ' 46' ' ' VAL . 21.4 m-20 -73.16 -31.1 64.04 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.766 177.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.675 HG12 HD21 ' A' ' 14' ' ' LEU . 39.4 mt -56.53 -48.13 80.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.191 0.519 . . . . 0.0 110.199 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -64.35 -38.0 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.251 178.287 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.673 ' O ' HG21 ' A' ' 29' ' ' VAL . 8.1 ttmt -60.59 -42.83 97.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.322 176.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.489 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -61.72 -36.34 80.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.02 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 25' ' ' GLN . 41.8 mt -65.77 -39.41 90.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.776 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.673 HG21 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -67.16 -30.68 50.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.222 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.741 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -85.87 -27.24 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.705 ' HB3' ' HB3' ' A' ' 37' ' ' MET . . . -92.94 10.69 30.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.416 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 45.88 39.24 5.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.526 0.679 . . . . 0.0 111.109 -174.55 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m120 62.18 48.26 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.96 -177.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' A' ' 38' ' ' ALA . 77.2 m-20 -94.13 150.68 20.11 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.634 173.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.687 HG22 ' HG3' ' A' ' 36' ' ' GLU . 4.6 tt -70.6 -53.63 21.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.341 0.591 . . . . 0.0 110.835 175.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 35' ' ' ILE . 25.4 mt-10 -71.65 -46.02 60.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.417 -172.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.705 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 49.5 tpp -68.25 -31.04 70.23 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.818 0.342 . . . . 0.0 110.861 -174.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -70.73 -51.62 26.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.724 177.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 ptpt -61.06 -29.61 69.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.401 . . . . 0.0 110.517 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -77.4 -34.63 54.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.801 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.741 HG13 HD13 ' A' ' 30' ' ' ILE . 13.2 mm -67.62 -37.65 79.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.711 176.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.645 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.53 -50.37 74.02 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -53.77 -28.95 37.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.394 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -89.28 -41.3 12.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.261 0.553 . . . . 0.0 111.731 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -95.34 -74.6 0.55 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.82 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.656 HG13 ' HB3' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -102.3 126.72 56.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.562 0.696 . . . . 0.0 112.745 -169.902 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.6 p -104.57 169.95 8.17 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.3 84.25 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.748 . . . . 0.0 109.855 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.7 t -108.68 34.2 3.8 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.308 -177.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.423 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 6.0 p -82.59 142.39 46.02 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.36 175.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 11.8 Cg_exo -71.2 59.17 2.35 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.1 2.533 . . . . 0.0 112.821 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.7 -17.93 39.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.246 178.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 12.9 p80 35.75 74.86 0.07 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.185 0.994 . . . . 0.0 112.419 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.1 m -82.78 128.22 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.089 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -112.35 115.94 29.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.833 -177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.948 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.764 178.781 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.526 HG21 ' HG ' ' A' ' 7' ' ' LEU . 7.6 t -145.38 -9.77 0.56 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.734 0.302 . . . . 0.0 111.164 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.01 13.89 8.04 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 85.2 p -85.53 139.91 35.9 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-O 121.349 0.595 . . . . 0.0 110.172 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.46 -27.13 84.19 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.435 2.756 . . . . 0.0 112.742 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 9' ' ' SER . 15.7 mm100 -74.86 -37.97 62.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.907 0.384 . . . . 0.0 110.681 179.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.568 ' C ' HD12 ' A' ' 7' ' ' LEU . 2.1 tm? -61.84 -47.05 86.79 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 173.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 42.7 t -57.58 -35.98 71.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.045 174.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.504 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.3 m -63.4 -31.01 72.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.617 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.573 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.4 mm-40 -61.18 -48.8 79.87 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.431 HG12 HD13 ' A' ' 28' ' ' LEU . 3.5 mp -55.53 -48.66 77.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.475 173.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.2 mt-10 -60.68 -25.87 66.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.25 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.573 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 5.5 t-20 -61.13 -51.53 68.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.654 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.632 HD21 HG12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -82.85 -23.62 33.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.449 -0.9 . . . . 0.0 110.597 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.637 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 8.8 mmm -57.06 -45.95 82.85 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.569 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -66.44 -13.12 60.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.901 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -80.35 -15.88 55.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.818 0.342 . . . . 0.0 110.106 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.81 -2.89 24.46 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.604 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.646 ' HB3' HD13 ' A' ' 42' ' ' LEU . 35.1 m-85 -63.93 170.95 3.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.982 0.42 . . . . 0.0 111.607 -177.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.6 m -106.84 129.15 54.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.532 0.682 . . . . 0.0 112.448 -172.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.8 p90 -55.64 -33.63 64.23 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.733 -173.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -59.6 -50.36 74.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.375 -177.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.666 ' CB ' HG13 ' A' ' 46' ' ' VAL . 2.5 m-20 -82.15 -23.58 35.51 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.941 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.632 HG12 HD21 ' A' ' 14' ' ' LEU . 44.3 mt -59.0 -50.41 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.439 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.689 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.03 -36.13 80.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.57 176.916 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.667 ' O ' HG23 ' A' ' 29' ' ' VAL . 9.7 ttpp -61.73 -43.44 98.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.179 177.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.692 ' HB3' ' HA ' ' A' ' 38' ' ' ALA . . . -58.94 -41.1 86.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.837 177.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 25' ' ' GLN . 27.6 mt -63.19 -38.31 90.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.891 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.55 -30.51 49.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.443 -176.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.812 HD13 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.13 -24.97 6.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.831 0.824 . . . . 0.0 109.284 174.746 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.81 ' CB ' ' HB3' ' A' ' 37' ' ' MET . . . -87.72 3.96 45.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.459 -175.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.504 HE21 ' ND2' ' A' ' 34' ' ' ASN . 2.2 pm0 43.67 40.15 2.82 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.532 0.682 . . . . 0.0 110.226 -171.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.2 m120 61.47 39.47 14.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.347 -1.297 . . . . 0.0 112.146 -177.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.504 ' ND2' HE21 ' A' ' 32' ' ' GLN . 58.2 m-20 -83.13 140.75 32.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.709 0.29 . . . . 0.0 110.48 172.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.697 HG22 ' H ' ' A' ' 36' ' ' GLU . 6.0 tt -59.05 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.199 176.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.697 ' H ' HG22 ' A' ' 35' ' ' ILE . 40.4 mt-10 -72.12 -42.78 65.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.935 -175.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.81 ' HB3' ' CB ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER -61.14 -34.17 74.57 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.423 -175.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.692 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . . . -70.27 -52.15 25.13 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.481 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HE3' HG12 ' A' ' 35' ' ' ILE . 18.0 ptpt -63.12 -29.21 70.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.722 178.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.432 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.1 m-20 -80.52 -39.26 28.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.502 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.812 HG13 HD13 ' A' ' 30' ' ' ILE . 11.0 mm -66.15 -38.24 81.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.186 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.646 HD13 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.76 -46.35 90.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 0.1 OUTLIER -53.71 -35.84 61.59 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.475 176.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.42 -32.63 22.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.975 0.417 . . . . 0.0 112.077 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 13.7 m-85 -108.46 -76.04 0.62 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -171.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.666 HG13 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -98.67 126.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.191 -171.017 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.7 m -100.24 176.16 5.48 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.98 -177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.435 HG23 ' H ' ' A' ' 49' ' ' SER . 0.5 OUTLIER -92.37 -154.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.903 -176.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.435 ' H ' HG23 ' A' ' 48' ' ' ILE . 66.2 m 60.66 46.9 8.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.419 0.628 . . . . 0.0 110.967 -175.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.491 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 20.7 p -82.59 128.55 66.13 Favored Pre-proline 0 N--CA 1.45 -0.455 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.975 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 1.1 Cg_endo -85.09 -86.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.798 2.332 . . . . 0.0 113.103 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.95 157.9 42.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.458 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 55.34 55.72 7.14 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.919 0.762 . . . . 0.0 109.674 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.43 HG13 ' HB2' ' A' ' 50' ' ' SER . 34.4 m -86.67 -2.02 7.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.635 -170.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.72 -74.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t . . . . . 0 C--O 1.251 1.174 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.244 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.441 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.3 tm? . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.8 t -66.31 -32.55 74.02 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.088 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.1 m -63.51 -29.78 71.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.02 173.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 65.4 mm-40 -61.31 -44.89 96.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 176.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 28' ' ' LEU . 53.6 mt -54.76 -49.9 65.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.967 172.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.658 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 23.3 mm-40 -56.91 -28.7 62.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.395 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.51 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 2.8 t-20 -62.33 -51.25 68.37 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.419 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.843 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.72 -24.08 31.36 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.246 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.658 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 25.6 mmm -54.35 -45.63 72.79 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.328 172.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 t -61.92 -21.57 64.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.331 -0.849 . . . . 0.0 110.818 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -82.79 -12.52 57.43 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.705 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 115.54 -10.63 19.21 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.794 176.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.735 ' HB3' HD12 ' A' ' 42' ' ' LEU . 38.4 m-85 -55.07 153.04 6.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.531 . . . . 0.0 112.047 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.5 m -96.4 133.02 41.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.997 -171.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.607 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 42.0 p90 -64.12 -26.07 68.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.51 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.433 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 12.6 pt20 -60.39 -48.28 82.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.253 0.549 . . . . 0.0 110.347 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.516 ' HB3' HG11 ' A' ' 46' ' ' VAL . 7.1 m-20 -80.27 -25.35 39.51 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.495 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 46.6 mt -60.19 -50.2 81.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.517 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 28' ' ' LEU . 23.6 tm0? -62.62 -34.91 78.0 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.721 ' O ' HG22 ' A' ' 29' ' ' VAL . 23.7 ttpt -61.01 -46.41 90.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.155 176.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.616 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -58.17 -39.54 79.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.899 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.4 mt -64.12 -36.86 85.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.896 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.3 m -68.94 -31.25 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.191 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.781 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -87.16 -32.12 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.351 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -86.88 8.73 21.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.944 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.71 54.09 2.5 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.495 0.664 . . . . 0.0 110.68 -174.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 46.8 45.98 15.07 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.663 -174.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 0.7 OUTLIER -77.85 163.49 26.02 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 175.715 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.711 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.5 tt -73.32 -71.9 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.711 ' H ' HG23 ' A' ' 35' ' ' ILE . 50.0 mt-10 -78.1 -35.4 49.3 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.57 -175.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.477 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 31.6 ttm -59.74 -34.5 73.03 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.196 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.19 -52.45 14.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.308 . . . . 0.0 111.657 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.631 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.9 ptpt -62.42 -28.8 70.04 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.905 0.384 . . . . 0.0 110.768 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.95 -38.84 66.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.849 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.781 HG13 HD12 ' A' ' 30' ' ' ILE . 12.4 mm -65.98 -38.6 82.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.194 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.735 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.97 -44.85 94.19 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.276 -0.57 . . . . 0.0 109.491 174.865 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -45.34 81.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.789 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.09 -39.21 66.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.352 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -101.27 -84.49 0.44 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -170.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.594 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.09 148.45 10.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.905 -171.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--N 1.322 -0.627 0 CA-C-O 120.998 0.428 . . . . 0.0 111.164 -178.297 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 10' ' ' GLU . 1.8 tm? . . . . . 0 C--O 1.223 -0.323 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 43.8 t -60.01 -30.72 69.33 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.969 174.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -76.83 -31.52 56.95 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.456 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.36 -38.94 91.58 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.559 HD11 HD11 ' A' ' 28' ' ' LEU . 54.8 mt -57.58 -49.86 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.174 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 48.6 mt-10 -58.98 -26.08 64.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.704 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.89 -49.11 71.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.974 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.813 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.73 -23.67 33.92 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.23 177.928 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.62 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 26.0 mmm -54.3 -42.52 70.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.8 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -64.91 -12.49 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -77.63 -15.11 59.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.048 0.452 . . . . 0.0 110.198 176.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.01 2.2 30.09 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.083 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -62.61 165.64 6.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.018 0.437 . . . . 0.0 111.227 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m -111.09 132.1 54.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.702 -173.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.7 p90 -63.73 -23.66 67.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.597 -172.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.463 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.6 pt20 -59.9 -53.75 54.22 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.955 0.407 . . . . 0.0 111.056 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.463 ' H ' ' HG3' ' A' ' 22' ' ' GLN . 5.3 m-20 -79.56 -25.13 41.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.714 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.745 HG13 HD11 ' A' ' 42' ' ' LEU . 38.9 mt -59.64 -49.28 84.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 109.897 171.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.697 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.7 tt0 -63.86 -35.58 81.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 32.8 ttmt -58.76 -48.74 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.289 175.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -55.64 -40.96 72.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.119 177.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.9 mt -63.35 -38.92 93.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.24 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.88 -30.88 49.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.256 -175.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.675 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -29.11 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.499 0.666 . . . . 0.0 109.396 177.348 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.638 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -89.82 10.5 23.36 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.349 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 44.82 45.02 8.2 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.525 0.678 . . . . 0.0 110.295 -174.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.58 40.51 15.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.998 1.319 . . . . 0.0 112.601 -173.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 9.1 m-20 -76.93 130.68 37.86 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.735 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.518 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.1 tt -57.02 -53.69 39.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.199 1.0 . . . . 0.0 110.195 177.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.496 ' H ' HG23 ' A' ' 35' ' ' ILE . 9.8 pt-20 -68.28 -44.92 74.45 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.939 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.638 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.5 tpt -73.26 -32.95 65.0 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.275 -172.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -67.51 -52.93 33.25 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 2.2 ptpm? -64.02 -29.33 70.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.788 0.328 . . . . 0.0 110.432 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.509 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 41.1 m-20 -70.19 -36.87 74.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.281 175.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.675 HG13 HD12 ' A' ' 30' ' ' ILE . 14.8 mm -67.82 -38.87 80.9 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.552 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.745 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -59.35 -45.26 91.88 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.572 -0.851 . . . . 0.0 109.197 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -42.12 70.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.677 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 21.2 mm-40 -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.323 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HG12 ' A' ' 46' ' ' VAL . 3.6 t80 -99.31 -75.67 0.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.765 0.793 . . . . 0.0 112.607 -166.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -98.33 142.06 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.575 -163.804 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.631 177.114 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 7' ' ' LEU . 1.2 tm? . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.699 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.0 t -65.62 -24.11 66.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.172 175.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -72.24 -32.25 66.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.231 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -60.1 -45.15 93.89 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.7 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.699 HD12 ' HA ' ' A' ' 8' ' ' SER . 82.5 mt -51.74 -48.82 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.83 172.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 13.4 mm-40 -62.4 -24.59 67.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.24 -178.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -67.43 -50.42 59.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.343 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.863 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.42 -23.4 50.61 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.686 178.325 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.581 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 20.3 mmm -56.67 -38.17 71.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.626 170.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.7 t -69.49 -10.01 56.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.579 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -88.95 -15.78 33.41 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.9 -7.93 21.65 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.572 177.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.51 ' HB3' HD12 ' A' ' 42' ' ' LEU . 24.8 m-85 -56.13 156.58 5.4 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -174.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.5 m -99.04 137.19 37.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.573 -173.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 33.7 m-85 -59.61 -33.0 70.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.282 -177.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -55.11 -50.81 68.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 111.105 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' HB3' HG11 ' A' ' 46' ' ' VAL . 8.6 m-20 -79.73 -27.37 40.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.401 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.673 HG13 HD11 ' A' ' 42' ' ' LEU . 40.9 mt -56.3 -49.11 78.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.738 0.304 . . . . 0.0 110.448 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.682 ' HA ' HD12 ' A' ' 28' ' ' LEU . 1.4 tm0? -62.03 -38.1 87.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.15 0.5 . . . . 0.0 109.685 176.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.699 ' O ' HG22 ' A' ' 29' ' ' VAL . 29.5 ttmt -57.7 -45.88 85.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.926 176.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.3 -41.1 88.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.028 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.682 HD12 ' HA ' ' A' ' 25' ' ' GLN . 30.7 mt -64.84 -38.44 90.97 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.637 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.699 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -66.61 -32.33 57.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.481 -176.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.673 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -31.86 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.585 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -87.53 9.08 22.21 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.227 -177.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 1.8 pm0 43.1 49.58 5.48 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.191 0.52 . . . . 0.0 110.302 -174.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 46.07 39.71 6.2 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.813 1.245 . . . . 0.0 112.694 -174.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.439 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 1.6 m120 -72.07 156.26 39.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.096 175.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.67 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.1 tt -67.53 -68.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.27 0.557 . . . . 0.0 110.979 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.67 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.0 mt-10 -76.07 -37.43 58.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.764 -174.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.585 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 12.4 tpt -62.3 -38.34 89.03 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.189 -0.605 . . . . 0.0 110.942 -174.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.41 -52.64 37.29 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.5 ptpt -60.98 -31.83 71.41 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.231 0.538 . . . . 0.0 110.698 179.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.496 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 75.1 m-20 -81.58 -28.83 33.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.727 -178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.673 HG13 HD12 ' A' ' 30' ' ' ILE . 9.0 mm -67.19 -39.07 82.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.738 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.251 177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.673 HD11 HG13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -61.06 -47.42 86.44 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.28 174.655 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 56.1 ttp85 -47.08 -44.2 20.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.52 174.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -77.73 -46.31 22.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.554 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.574 ' HB3' HG12 ' A' ' 46' ' ' VAL . 6.1 t80 -82.71 -64.15 1.23 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.665 0.745 . . . . 0.0 112.365 -167.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.574 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.1 OUTLIER -108.06 145.83 14.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.604 -1.18 . . . . 0.0 112.399 -165.029 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 C--N 1.319 -0.757 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.279 175.599 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--O 1.224 -0.253 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -63.09 -38.37 90.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.179 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.447 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 58.6 m -65.0 -28.17 69.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.553 174.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.47 ' OE1' HG13 ' A' ' 35' ' ' ILE . 1.4 tp10 -66.91 -42.92 84.6 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 HG21 ' A' ' 24' ' ' ILE . 2.0 mp -52.26 -42.85 38.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 121.052 0.453 . . . . 0.0 110.515 169.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 36.3 mt-10 -63.82 -24.02 67.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.348 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -70.52 -50.49 37.24 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.158 -178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.796 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -72.48 -23.99 61.11 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.654 176.788 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.614 ' N ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -57.18 -34.29 68.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.072 175.262 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -67.06 -13.06 61.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.743 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -85.58 -12.22 52.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.649 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.2 -3.59 29.89 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.417 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' HD12 ' A' ' 42' ' ' LEU . 20.6 m-85 -58.13 157.99 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.479 0.657 . . . . 0.0 112.474 -174.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.491 ' HB2' ' HG2' ' A' ' 22' ' ' GLN . 1.3 p -95.84 135.19 37.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.667 -175.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.62 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 48.3 p90 -66.57 -26.91 67.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.118 -176.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 20' ' ' SER . 8.8 pt20 -63.13 -45.91 89.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.713 0.768 . . . . 0.0 109.954 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.529 ' HB3' HG11 ' A' ' 46' ' ' VAL . 20.9 m-20 -81.13 -29.13 34.86 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.485 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.637 HG13 HD11 ' A' ' 42' ' ' LEU . 39.8 mt -57.44 -48.53 82.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.177 173.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.666 ' HA ' HD12 ' A' ' 28' ' ' LEU . 54.3 tt0 -63.07 -39.94 96.21 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.711 ' O ' HG22 ' A' ' 29' ' ' VAL . 36.4 ttmt -53.88 -47.26 71.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.062 176.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.93 -41.79 92.57 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.328 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 25' ' ' GLN . 31.4 mt -64.95 -36.57 84.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.778 -177.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.0 m -67.1 -30.52 49.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.197 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.842 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.67 -32.92 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-O 121.218 0.533 . . . . 0.0 109.579 174.189 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.598 ' HA ' ' SD ' ' A' ' 37' ' ' MET . . . -82.95 4.3 26.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.765 -177.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.6 OUTLIER 42.49 43.83 3.3 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.602 0.715 . . . . 0.0 110.768 -172.064 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 58.1 49.05 12.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.725 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.597 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 1.2 m-80 -83.59 163.74 20.18 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 173.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.687 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.8 tt -78.4 -64.22 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 121.606 0.717 . . . . 0.0 109.199 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.687 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.2 pt-20 -76.29 -36.89 58.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.264 -174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 31' ' ' ALA . 38.4 ttm -63.79 -29.66 70.84 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.723 0.297 . . . . 0.0 111.204 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.624 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -77.05 -52.83 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.7 ptpt -60.08 -29.89 68.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.05 0.453 . . . . 0.0 110.637 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -75.16 -36.92 61.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.799 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.842 HG13 HD12 ' A' ' 30' ' ' ILE . 10.6 mm -66.48 -38.6 82.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.047 177.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.637 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.66 -49.07 78.9 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.185 174.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.64 -45.77 66.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.477 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.81 -41.21 71.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 111.995 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -93.84 -73.0 0.58 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.48 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.529 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -96.08 139.44 19.17 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.4 -168.59 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.518 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 CA--C 1.523 -0.087 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.7 t -65.71 -32.17 73.57 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.943 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.1 m -63.78 -32.35 73.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.542 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.1 mm-40 -64.38 -48.31 75.93 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.768 HG22 ' HG3' ' A' ' 15' ' ' MET . 69.9 mt -52.84 -51.15 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.46 171.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.708 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -57.53 -27.51 62.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.771 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.451 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 3.0 t-20 -60.81 -50.65 72.59 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.544 0.211 . . . . 0.0 110.745 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.845 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.96 -24.42 30.66 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 119.166 -1.013 . . . . 0.0 110.946 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.768 ' HG3' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -60.11 -39.69 87.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.91 175.587 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -66.07 -17.4 64.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.044 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.706 ' OE1' ' HA ' ' A' ' 14' ' ' LEU . 39.5 mt-30 -80.43 -16.82 53.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.964 0.412 . . . . 0.0 110.951 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.72 -2.18 24.61 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.316 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.476 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.3 m-85 -59.08 166.96 1.85 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.17 0.509 . . . . 0.0 111.739 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -104.71 133.98 48.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.992 -172.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.598 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 31.5 p90 -65.16 -28.57 69.5 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.927 -170.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -62.23 -52.14 64.96 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.008 0.432 . . . . 0.0 110.878 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.609 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.4 m-20 -74.74 -25.01 58.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.352 177.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.691 HD13 ' HG2' ' A' ' 15' ' ' MET . 42.1 mt -60.66 -49.5 84.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.002 0.429 . . . . 0.0 110.05 173.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 29.6 tt0 -63.9 -37.31 86.91 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.381 176.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 37.4 ttmt -54.66 -50.61 67.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.035 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -56.64 -41.1 76.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.087 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.0 mt -63.95 -37.93 89.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -68.97 -30.41 46.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.06 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.739 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.61 -27.42 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.139 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.33 10.68 26.4 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.768 -176.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 43.15 46.91 5.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.275 0.56 . . . . 0.0 110.639 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 51.61 33.2 10.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.224 1.41 . . . . 0.0 113.277 -176.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 11.7 m-20 -70.99 149.69 46.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.339 174.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.56 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.2 tt -65.77 -59.69 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-O 121.605 0.716 . . . . 0.0 110.4 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.56 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.3 pt-20 -75.53 -40.48 56.9 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.982 -172.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.591 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 43.0 tpp -67.71 -32.79 73.67 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.886 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.555 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.54 -51.92 37.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.893 0.377 . . . . 0.0 111.808 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.486 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.7 ptpt -62.65 -29.24 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.638 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -77.08 -39.9 48.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.739 HG13 HD12 ' A' ' 30' ' ' ILE . 11.9 mm -63.74 -38.79 83.23 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.402 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.688 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -60.29 -48.5 81.46 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.083 173.812 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -40.9 65.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.667 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.94 -31.99 57.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.028 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 11.4 m-85 -106.48 -80.56 0.56 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.609 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.18 135.27 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.164 -170.819 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.4 p . . . . . 0 C--N 1.318 -0.781 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.648 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.43 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.4 tm? . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.552 ' HA ' HD13 ' A' ' 11' ' ' ILE . 38.6 t -65.69 -24.67 67.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.193 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.1 t -70.0 -30.83 68.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.534 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 73.2 mm-40 -58.75 -46.87 86.47 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.701 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -53.09 -50.34 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.779 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 5.7 mm-40 -61.85 -24.68 67.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.665 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 9.6 t-20 -63.87 -50.9 67.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.839 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -80.22 -22.91 41.32 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.956 179.119 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 12.9 mmm -56.58 -38.0 71.38 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.632 171.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -64.79 -12.09 43.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.724 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -92.26 -14.98 28.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.606 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.77 -5.04 22.65 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.73 176.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.742 ' HB3' HD12 ' A' ' 42' ' ' LEU . 41.9 m-85 -59.57 163.77 3.98 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 111.686 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 24' ' ' ILE . 53.4 m -108.78 136.3 48.58 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -171.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.571 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.6 m-85 -57.56 -36.97 72.36 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.638 -174.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.93 -50.17 69.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.919 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.774 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.5 m-20 -81.82 -23.12 36.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.701 HG21 HG23 ' A' ' 11' ' ' ILE . 42.2 mt -58.19 -49.83 80.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.794 0.33 . . . . 0.0 110.188 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.8 tt0 -62.39 -38.17 88.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.342 0.592 . . . . 0.0 109.626 176.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.654 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 20.8 mtpp -58.64 -38.89 79.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.058 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.6 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -66.37 -38.96 88.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.523 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.7 mt -64.11 -37.24 86.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.521 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 26' ' ' LYS . 5.1 m -68.53 -30.89 48.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.344 -177.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.755 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.57 -29.12 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.718 0.771 . . . . 0.0 109.708 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.17 8.44 27.0 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.993 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 40.43 52.0 2.9 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.531 0.681 . . . . 0.0 111.008 -172.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 47.01 44.71 15.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.982 1.313 . . . . 0.0 112.613 -174.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -79.38 154.87 28.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.05 175.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.709 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.0 tt -65.56 -70.6 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.782 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.709 ' H ' HG23 ' A' ' 35' ' ' ILE . 47.6 mm-40 -75.35 -36.89 60.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.618 -173.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.582 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 14.4 tpt -63.02 -36.3 83.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.225 -174.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.36 -52.61 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.921 0.391 . . . . 0.0 111.825 178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.61 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.5 ptpt -62.93 -29.67 70.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.927 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.6 m-20 -78.32 -32.53 49.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.328 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.755 HG13 HD12 ' A' ' 30' ' ' ILE . 13.0 mm -67.4 -38.51 80.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.199 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -58.09 -54.14 50.31 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.928 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 46.8 ttt180 -44.9 -52.82 8.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.563 175.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.87 -44.71 84.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.774 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 20.7 m-85 -99.94 -80.68 0.47 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -85.61 125.91 40.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -172.505 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.64 -178.561 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 33' ' ' ASN . 1.5 tm? . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.733 ' HA ' HD12 ' A' ' 11' ' ' ILE . 30.6 t -56.67 -35.71 68.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 174.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -63.98 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.498 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.482 ' HB3' ' HA ' ' A' ' 35' ' ' ILE . 2.8 mm-40 -63.48 -48.05 79.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 176.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.733 HD12 ' HA ' ' A' ' 8' ' ' SER . 14.5 mt -59.96 -49.85 82.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.118 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.694 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.1 mt-10 -63.06 -25.19 68.26 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.675 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -62.36 -51.29 68.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.456 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.786 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.19 -24.03 35.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.64 176.605 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.694 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 1.2 mmt -54.12 -29.0 43.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.785 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 t -75.5 -9.69 58.8 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.186 0.517 . . . . 0.0 110.438 -169.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' OE1' ' HA ' ' A' ' 14' ' ' LEU . 1.0 OUTLIER -80.88 -23.82 38.75 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.301 -179.116 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.46 4.8 21.61 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.291 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -61.96 167.79 3.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.054 0.454 . . . . 0.0 111.186 -177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.8 m -104.14 130.71 51.88 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.336 -170.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 10.9 p90 -67.09 -23.64 65.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.519 -170.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.505 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.3 pt20 -59.82 -53.9 52.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.083 0.468 . . . . 0.0 110.578 177.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.731 ' HB3' HG11 ' A' ' 46' ' ' VAL . 1.5 m-20 -82.93 -23.83 33.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.497 -179.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.641 HG13 HD11 ' A' ' 42' ' ' LEU . 24.3 mt -59.86 -50.2 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.644 0.259 . . . . 0.0 110.381 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.746 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.5 tt0 -65.11 -34.73 79.09 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.678 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.0 ttpp -61.34 -40.28 93.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.12 177.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.23 -39.59 95.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.687 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 25' ' ' GLN . 35.7 mt -64.93 -36.59 84.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.494 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.678 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.6 m -69.33 -30.04 44.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.413 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.79 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.37 -31.24 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.585 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.39 11.56 16.54 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.53 -177.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 36.05 43.97 0.23 Allowed 'General case' 0 N--CA 1.474 0.764 0 O-C-N 124.019 0.825 . . . . 0.0 112.316 -171.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.555 ' HB3' HD21 ' A' ' 7' ' ' LEU . 36.3 m-80 68.76 29.73 5.09 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.035 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 14.5 m-20 -72.62 151.13 42.48 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 120.999 0.428 . . . . 0.0 110.603 171.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.821 HG23 ' HG3' ' A' ' 36' ' ' GLU . 11.8 tt -72.79 -53.1 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.363 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.821 ' HG3' HG23 ' A' ' 35' ' ' ILE . 19.2 mt-10 -75.62 -45.26 38.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.98 -175.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 17.4 tpt -63.59 -30.16 71.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 -175.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -75.09 -51.98 12.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.875 176.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HE3' HG12 ' A' ' 35' ' ' ILE . 19.3 ptpt -60.9 -31.16 70.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.002 0.43 . . . . 0.0 110.51 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -69.4 -41.77 75.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.448 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.79 HG13 HD12 ' A' ' 30' ' ' ILE . 14.1 mm -65.83 -38.61 82.6 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.232 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.641 HD11 HG13 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.3 -50.38 73.86 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 172.535 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -53.76 -36.66 62.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.283 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -81.36 -31.09 33.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.015 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 16.7 m-85 -110.31 -79.8 0.58 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.2 -171.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.731 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -97.18 127.27 49.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.049 -173.304 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.709 -175.425 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 CA--C 1.523 -0.084 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.4 t -60.11 -35.03 74.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.018 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.2 m -60.98 -29.57 69.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.464 177.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.595 ' HB3' ' HB ' ' A' ' 35' ' ' ILE . 3.5 mm-40 -63.24 -49.47 73.99 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.442 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.7 mp -58.51 -49.3 82.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.42 174.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 50.4 mt-10 -63.51 -24.49 67.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.995 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -61.9 -50.09 73.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.504 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.824 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.15 -23.27 38.39 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.275 178.104 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.637 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 22.4 mmm -57.28 -26.39 60.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.787 177.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.6 p -61.41 -22.78 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.956 0.408 . . . . 0.0 111.104 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -79.62 -20.41 46.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.071 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.83 6.16 26.73 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.511 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -60.4 172.88 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.5 m -112.4 134.47 53.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.468 -170.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.448 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 70.3 m-85 -58.54 -35.37 72.21 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.725 -173.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.486 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 15.5 pt20 -56.35 -54.33 46.77 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.557 0.536 . . . . 0.0 111.724 -176.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.667 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 5.9 m-20 -80.74 -23.56 39.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.724 HG13 HD11 ' A' ' 42' ' ' LEU . 23.8 mt -59.12 -50.08 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.919 0.39 . . . . 0.0 110.084 173.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.727 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.9 tt0 -60.8 -40.77 93.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.533 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 16.1 mtpp -57.66 -43.69 85.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.069 175.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.37 -42.06 98.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.359 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 25' ' ' GLN . 39.2 mt -61.83 -37.28 83.87 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.931 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.5 m -69.03 -30.98 48.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.293 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.804 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.88 -30.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.437 0.637 . . . . 0.0 109.349 175.459 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.621 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.3 12.99 12.55 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.422 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 40.35 52.17 2.86 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.875 0.734 . . . . 0.0 110.88 -176.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.52 51.35 15.52 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.449 -1.25 . . . . 0.0 112.856 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.475 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -93.48 158.77 15.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.36 174.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.625 HG23 ' HG3' ' A' ' 36' ' ' GLU . 6.2 tt -77.44 -60.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.003 176.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.671 ' HA ' ' HG2' ' A' ' 39' ' ' LYS . 3.5 mt-10 -73.49 -43.82 59.26 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.617 -174.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.621 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 16.0 tpt -62.95 -33.98 76.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.35 -175.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.589 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -72.1 -51.95 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.791 176.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.671 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 10.4 ptpt -60.56 -31.22 70.34 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.095 0.474 . . . . 0.0 110.76 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.414 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 75.2 m-20 -78.56 -35.08 46.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.577 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.804 HG13 HD12 ' A' ' 30' ' ' ILE . 11.4 mm -67.12 -38.78 81.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.595 174.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.724 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -58.49 -49.07 78.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.161 172.575 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.01 -33.82 62.94 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.197 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 34.7 mm-40 -83.02 -25.87 31.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.957 0.408 . . . . 0.0 112.007 178.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -110.9 -75.17 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.466 0.65 . . . . 0.0 112.17 -171.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.44 HG11 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -96.84 146.23 7.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.036 -168.26 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.5 p . . . . . 0 C--N 1.318 -0.774 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.767 178.662 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.7 tm? . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' ' HG2' ' A' ' 12' ' ' GLU . 43.1 t -62.52 -30.75 71.51 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.16 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.9 m -60.85 -31.11 70.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.151 174.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.9 ' HB3' HD13 ' A' ' 35' ' ' ILE . 18.9 mm-40 -60.69 -49.89 75.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.077 0.465 . . . . 0.0 109.794 172.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.507 HG23 HG21 ' A' ' 24' ' ' ILE . 2.8 mp -54.15 -46.08 66.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.611 173.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -59.26 -25.31 63.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.601 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 7.0 t-20 -64.04 -51.76 62.62 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.878 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -78.85 -23.49 44.94 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.136 179.159 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.644 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.19 -39.47 86.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.352 173.662 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.6 t -69.74 -11.92 61.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.154 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -86.32 -22.5 26.71 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.256 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 122.87 -9.3 9.11 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.054 176.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.861 ' HB3' HD12 ' A' ' 42' ' ' LEU . 50.2 m-85 -61.03 162.49 7.05 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.933 0.397 . . . . 0.0 111.933 -175.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -100.82 133.23 45.6 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.417 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 0.3 OUTLIER -54.86 -35.96 64.58 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.92 -172.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -62.87 -51.72 65.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 -175.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.75 ' HB3' HG11 ' A' ' 46' ' ' VAL . 12.7 m-20 -79.08 -23.52 44.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.76 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.575 HD13 ' HG2' ' A' ' 15' ' ' MET . 34.9 mt -58.69 -50.08 80.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 172.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.74 ' HA ' HD12 ' A' ' 28' ' ' LEU . 18.8 tm0? -62.98 -39.66 95.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 43.4 mtpt -57.84 -45.28 86.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.39 175.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.552 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -59.84 -37.59 79.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.83 0.348 . . . . 0.0 110.816 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.2 mt -64.23 -38.59 91.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.872 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -68.79 -30.96 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.77 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.51 -28.43 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.299 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.03 12.22 20.48 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.596 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 43.33 47.68 5.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.447 0.641 . . . . 0.0 110.665 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.63 35.97 12.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.265 1.426 . . . . 0.0 113.34 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.42 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.0 m-20 -77.04 142.23 39.96 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.585 169.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.9 HD13 ' HB3' ' A' ' 10' ' ' GLU . 2.4 tp -68.01 -54.99 18.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-O 121.253 0.549 . . . . 0.0 110.76 174.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.473 ' H ' HG23 ' A' ' 35' ' ' ILE . 25.7 mt-10 -65.75 -48.44 71.87 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.677 -174.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.629 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 53.4 tpp -64.97 -32.31 73.98 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.712 -176.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.552 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.5 -51.88 25.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 16.5 ptpt -62.14 -29.05 70.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.107 0.48 . . . . 0.0 110.149 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.2 -39.56 60.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.014 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.77 HG13 HD12 ' A' ' 30' ' ' ILE . 10.5 mm -63.88 -38.87 83.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.356 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.861 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 172.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -54.71 -34.79 62.88 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.482 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -86.21 -27.6 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.878 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 8.0 m-85 -114.76 -79.37 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.187 0.518 . . . . 0.0 111.956 -174.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -98.02 117.69 43.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.855 -175.154 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.562 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 1.7 p . . . . . 0 C--N 1.312 -1.024 0 CA-C-O 121.502 0.668 . . . . 0.0 111.576 -174.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 121.586 0.708 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -66.93 -24.33 66.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.27 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.7 m -71.07 -31.78 68.28 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.767 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.93 -47.19 86.79 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.699 HD11 HD11 ' A' ' 28' ' ' LEU . 87.8 mt -56.19 -53.67 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.755 174.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.574 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 11.5 mm-40 -57.21 -25.84 59.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.958 -176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -66.34 -51.09 60.78 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.867 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.751 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.64 -22.65 43.31 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.811 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 16.6 mmm -53.73 -38.87 64.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.748 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.9 m -71.63 -3.07 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.003 -177.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -87.98 -16.76 32.86 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 -2.68 24.16 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.76 176.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.0 m-85 -61.36 168.57 2.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.191 0.52 . . . . 0.0 111.974 -176.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -113.67 136.08 53.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.119 -169.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.628 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.0 m-85 -59.55 -34.92 73.27 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.139 -174.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -53.61 -50.59 65.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.018 0.437 . . . . 0.0 111.191 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.544 ' HB3' HG11 ' A' ' 46' ' ' VAL . 23.1 m-20 -82.49 -26.86 32.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.784 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.628 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 41.3 mt -60.17 -49.98 82.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.201 0.524 . . . . 0.0 110.398 174.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.735 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.91 -35.49 80.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.961 178.192 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 1.5 ttmm -59.04 -45.98 89.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.829 176.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.497 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.39 -40.6 82.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.95 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.4 mt -62.19 -40.1 94.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.688 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.6 m -67.63 -31.53 52.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.264 -175.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.653 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -27.66 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-O 121.726 0.774 . . . . 0.0 109.265 177.035 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.649 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.94 13.62 18.07 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.434 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 42.15 43.78 2.95 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.643 0.589 . . . . 0.0 111.527 -175.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 55.25 57.05 5.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.795 -175.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 3.7 t-20 -90.26 154.13 19.96 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.494 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.699 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.6 tt -67.3 -64.92 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.913 169.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 35' ' ' ILE . 26.8 mt-10 -71.64 -49.78 36.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.309 -175.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.649 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 3.2 tpt -62.22 -34.58 76.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.342 -168.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -69.68 -52.73 23.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.799 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.603 ' HB3' HD12 ' A' ' 14' ' ' LEU . 1.4 ptpm? -66.01 -29.03 69.33 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.773 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 89.4 m-20 -76.14 -32.64 59.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.205 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.653 HG13 HD12 ' A' ' 30' ' ' ILE . 10.8 mm -68.01 -38.41 79.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.186 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.683 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -57.04 -51.39 69.48 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 172.14 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 21.9 ttp180 -48.45 -48.96 37.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.89 175.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 43.8 mt-10 -77.78 -24.34 48.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.862 -175.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 10.2 m-85 -116.16 -75.92 0.58 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -171.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.683 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -86.37 138.3 19.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.383 -170.567 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 C--N 1.317 -0.825 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.433 176.152 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.3 tm? . . . . . 0 N--CA 1.461 0.125 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.586 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 45.6 t -63.75 -26.68 68.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.807 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.4 m -69.39 -30.79 68.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.999 173.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 4.2 mm-40 -63.0 -34.61 77.92 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.643 HG23 HG21 ' A' ' 24' ' ' ILE . 51.2 mt -55.03 -48.62 75.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.895 171.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.717 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 44.3 mt-10 -58.16 -25.85 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.012 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -64.55 -48.05 76.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.176 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.879 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.06 -24.28 32.8 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.669 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.717 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 23.9 mmm -55.15 -45.6 75.68 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.913 176.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.4 p -68.81 -3.53 12.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.996 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -88.22 -12.88 42.49 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.192 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.69 -8.06 22.02 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.192 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.652 ' HB3' HD12 ' A' ' 42' ' ' LEU . 37.3 m-85 -61.75 157.22 18.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.124 0.488 . . . . 0.0 111.183 -176.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.2 m -100.87 129.51 46.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.338 0.59 . . . . 0.0 111.619 -171.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.713 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.2 p90 -60.71 -26.4 67.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.231 -174.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -59.14 -51.62 69.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.074 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.665 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -82.28 -22.61 35.66 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.024 177.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.713 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 39.6 mt -57.76 -50.24 78.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.83 0.348 . . . . 0.0 110.674 174.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.5 tt0 -61.85 -38.35 87.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.607 0.717 . . . . 0.0 109.529 176.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 34.4 mtpt -61.4 -40.11 93.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.214 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.533 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -65.27 -38.06 89.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.89 176.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.9 mt -63.56 -36.27 83.23 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.651 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -70.04 -30.76 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.102 -177.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.734 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -26.62 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.401 0.619 . . . . 0.0 109.486 175.523 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.27 10.79 28.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 1.5 pm0 43.54 47.18 6.16 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.248 0.546 . . . . 0.0 110.676 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 47.4 43.23 15.23 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.788 1.235 . . . . 0.0 112.89 -174.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -81.68 136.69 35.49 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.61 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.676 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.7 tt -61.31 -48.03 90.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.805 176.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.676 ' HG3' HG23 ' A' ' 35' ' ' ILE . 27.0 mt-10 -72.86 -49.72 28.34 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.134 -174.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 59.6 tpp -67.43 -34.21 76.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.227 -172.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.533 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -64.79 -51.95 59.48 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 178.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -62.51 -29.9 70.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.98 0.419 . . . . 0.0 110.502 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -77.58 -37.12 51.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.734 HG13 HD12 ' A' ' 30' ' ' ILE . 15.4 mm -65.54 -37.82 80.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.544 177.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.801 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -55.43 -57.72 10.71 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.754 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.12 -41.16 16.9 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.292 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.02 -38.87 31.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 17.9 m-85 -101.23 -71.58 0.71 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.334 0.588 . . . . 0.0 112.229 -171.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.801 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -92.09 134.82 29.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.213 -170.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--N 1.314 -0.97 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.971 -175.9 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.409 ' HA ' ' HG2' ' A' ' 10' ' ' GLU . 4.7 tt . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 39.9 t -57.95 -35.26 70.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.492 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.6 m -66.36 -31.96 73.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.507 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.409 ' HG2' ' HA ' ' A' ' 7' ' ' LEU . 2.1 mm-40 -62.08 -45.55 93.03 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.583 HG23 HG21 ' A' ' 24' ' ' ILE . 3.4 mp -58.75 -48.99 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.65 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.614 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 46.6 mt-10 -61.15 -26.54 67.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -62.95 -50.37 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.818 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.819 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.02 -23.03 36.16 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.055 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.614 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 10.1 mmm -56.24 -45.73 79.86 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.036 175.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.8 p -72.45 -2.51 19.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.071 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -85.12 -19.06 32.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.29 -3.52 18.41 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.654 177.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 42' ' ' LEU . 45.2 m-85 -64.13 168.76 5.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.008 0.432 . . . . 0.0 111.383 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.9 m -105.95 131.03 53.74 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.262 0.553 . . . . 0.0 111.935 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.2 p90 -61.46 -30.58 70.69 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.945 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 23' ' ' ASP . 22.5 pt20 -56.89 -52.96 63.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.962 0.411 . . . . 0.0 110.981 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.714 ' HB3' HG11 ' A' ' 46' ' ' VAL . 9.2 m-20 -80.87 -23.15 39.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.583 HG21 HG23 ' A' ' 11' ' ' ILE . 54.0 mt -59.26 -50.21 80.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.724 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -66.02 -34.54 78.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.787 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 40.9 mtpt -59.86 -46.35 89.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.985 174.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.74 -38.21 77.91 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.196 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.3 mt -63.57 -37.52 87.63 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -69.65 -30.37 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.14 -177.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.796 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.54 -28.08 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-O 121.448 0.642 . . . . 0.0 109.335 176.413 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.626 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.88 11.99 25.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.565 -176.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 41.85 47.89 3.72 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.456 0.646 . . . . 0.0 110.458 -174.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.5 p30 48.32 40.24 14.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.923 1.289 . . . . 0.0 113.165 -175.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 8.0 m-20 -74.65 148.87 40.27 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.393 171.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.577 HG23 ' H ' ' A' ' 36' ' ' GLU . 3.5 tt -65.33 -59.66 3.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.25 0.548 . . . . 0.0 110.979 173.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.577 ' H ' HG23 ' A' ' 35' ' ' ILE . 44.7 mt-10 -71.3 -45.96 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.015 -173.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.626 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.6 tpt -64.92 -33.22 75.5 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.912 -172.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.502 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.76 -52.42 30.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.725 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HZ3' HD12 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -63.81 -29.98 71.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.095 0.474 . . . . 0.0 110.635 179.002 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -75.56 -35.15 60.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.622 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.796 HG13 HD12 ' A' ' 30' ' ' ILE . 12.6 mm -65.48 -38.32 82.18 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.449 175.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.617 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -59.32 -54.51 45.93 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 171.629 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 tmm_? -52.93 -40.32 63.52 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.91 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.97 -44.31 61.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 111.966 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 29.2 m-85 -100.38 -80.55 0.48 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.67 -172.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.714 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.82 122.03 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.111 -172.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.409 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.8 m . . . . . 0 C--N 1.312 -1.052 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.553 -176.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.1 t -62.49 -29.66 70.7 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.093 175.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.2 m -67.59 -30.95 70.68 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.531 176.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.17 -46.13 90.32 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.506 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -54.17 -51.55 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.506 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 63.6 mm-40 -58.84 -26.25 63.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.651 -178.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -62.78 -50.85 69.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.414 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.836 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.87 -23.84 36.1 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.25 177.629 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.704 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -56.21 -32.48 64.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.941 176.542 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 t -59.35 -22.59 61.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.824 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -78.99 -21.53 46.9 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.245 -179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.79 1.65 22.69 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.744 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CG ' HD12 ' A' ' 42' ' ' LEU . 30.9 m-85 -57.62 167.4 1.08 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 112.305 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 p -99.25 135.22 40.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.333 -173.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.465 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 7.5 m-85 -62.7 -31.83 72.81 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.17 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -62.17 -48.43 80.12 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.609 0.719 . . . . 0.0 110.504 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.8 ' HB3' HG11 ' A' ' 46' ' ' VAL . 40.4 m-20 -82.75 -29.01 30.02 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.456 -177.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.565 HG13 HD11 ' A' ' 42' ' ' LEU . 23.1 mt -57.14 -49.11 80.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.026 172.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.709 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.3 tt0 -62.49 -39.83 94.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.914 176.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.662 ' O ' HG22 ' A' ' 29' ' ' VAL . 3.2 ttmm -55.63 -42.94 75.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.958 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.568 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -63.99 -41.6 97.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.957 178.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 25' ' ' GLN . 28.6 mt -63.62 -40.23 96.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.463 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.8 m -64.86 -31.21 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.211 -176.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.764 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.97 -32.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.334 0.588 . . . . 0.0 109.58 175.907 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -85.47 8.68 18.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.234 -177.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER 44.65 40.49 4.14 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.755 0.659 . . . . 0.0 110.999 -175.321 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 61.82 55.32 2.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.38 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.48 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.9 m-20 -103.05 145.0 30.55 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.685 175.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' H ' ' A' ' 36' ' ' GLU . 4.3 tt -62.6 -57.8 10.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.836 0.35 . . . . 0.0 111.384 176.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.535 ' H ' HG23 ' A' ' 35' ' ' ILE . 43.8 mt-10 -68.58 -50.87 48.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.516 -176.043 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.601 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.7 tpt -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.243 -170.035 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.568 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -71.53 -52.19 19.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.771 0.319 . . . . 0.0 111.822 177.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 1.2 ptpm? -63.89 -28.99 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.907 0.384 . . . . 0.0 110.287 179.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.553 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 97.5 m-20 -76.36 -31.01 57.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.903 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.764 HG13 HD12 ' A' ' 30' ' ' ILE . 13.6 mm -70.57 -38.32 73.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.875 174.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.565 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -60.39 -48.51 81.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 170.88 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 8.7 tpm_? -46.02 -48.91 16.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.287 175.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 33.7 mm-40 -74.72 -43.95 52.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.517 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 23.0 m-85 -97.88 -74.92 0.56 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.592 0.711 . . . . 0.0 112.516 -170.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.8 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -100.44 126.21 54.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.93 -169.539 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 p . . . . . 0 C--N 1.312 -1.042 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.207 175.831 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 22.7 t -59.79 -33.76 72.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.853 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.5 m -64.24 -30.71 71.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.143 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.3 mm-40 -60.66 -45.96 92.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 HG21 ' A' ' 24' ' ' ILE . 3.2 mp -56.08 -46.29 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.284 173.123 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 38.8 mt-10 -59.17 -26.5 64.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.093 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -63.38 -51.39 66.06 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.867 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.91 -23.42 41.81 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 119.196 -1.001 . . . . 0.0 110.165 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.61 ' N ' HD22 ' A' ' 14' ' ' LEU . 12.2 mmm -57.94 -35.93 71.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.385 177.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.8 t -73.74 1.23 10.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.657 -177.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -94.24 -18.13 21.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.719 0.295 . . . . 0.0 110.404 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.75 0.35 24.46 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.574 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -63.61 166.99 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.237 0.542 . . . . 0.0 112.192 -176.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -102.01 130.32 48.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.369 -172.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 41.1 p90 -62.85 -30.4 71.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.611 -171.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.556 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 1.5 pt20 -64.32 -49.7 70.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.192 0.52 . . . . 0.0 110.629 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.702 ' HB3' HG11 ' A' ' 46' ' ' VAL . 21.4 m-20 -73.16 -31.1 64.04 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.766 177.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.669 HG13 HD11 ' A' ' 42' ' ' LEU . 39.4 mt -56.53 -48.13 80.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.191 0.519 . . . . 0.0 110.199 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.72 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -64.35 -38.0 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.251 178.287 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.1 ttmt -60.59 -42.83 97.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.322 176.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.591 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -61.72 -36.34 80.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.02 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.72 HD12 ' HA ' ' A' ' 25' ' ' GLN . 41.8 mt -65.77 -39.41 90.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.776 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -67.16 -30.68 50.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.222 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.852 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -85.87 -27.24 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.897 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.94 10.69 30.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.416 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER 45.88 39.24 5.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.526 0.679 . . . . 0.0 111.109 -174.55 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m120 62.18 48.26 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.96 -177.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.461 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 77.2 m-20 -94.13 150.68 20.11 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.634 173.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.769 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.6 tt -70.6 -53.63 21.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.341 0.591 . . . . 0.0 110.835 175.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.769 ' HG3' HG23 ' A' ' 35' ' ' ILE . 25.4 mt-10 -71.65 -46.02 60.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.417 -172.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.654 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 49.5 tpp -68.25 -31.04 70.23 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.818 0.342 . . . . 0.0 110.861 -174.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.591 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.73 -51.62 26.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.724 177.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 ptpt -61.06 -29.61 69.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.401 . . . . 0.0 110.517 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 14.3 m-80 -77.4 -34.63 54.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.801 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.852 HG13 HD12 ' A' ' 30' ' ' ILE . 13.2 mm -67.62 -37.65 79.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.711 176.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.669 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.53 -50.37 74.02 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.638 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -53.77 -28.95 37.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.394 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 30.2 mt-10 -89.28 -41.3 12.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.261 0.553 . . . . 0.0 111.731 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -95.34 -74.6 0.55 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.82 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.702 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -102.3 126.72 56.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.562 0.696 . . . . 0.0 112.745 -169.902 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 C--N 1.314 -0.944 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.335 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 ' HA ' ' A' ' 7' ' ' LEU . 2.1 tm? . . . . . 0 C--O 1.226 -0.151 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 42.7 t -57.58 -35.98 71.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.045 174.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -63.4 -31.01 72.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.617 177.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.4 mm-40 -61.18 -48.8 79.87 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.509 HG23 HG21 ' A' ' 24' ' ' ILE . 3.5 mp -55.53 -48.66 77.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.475 173.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.68 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.2 mt-10 -60.68 -25.87 66.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.25 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.586 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 5.5 t-20 -61.13 -51.53 68.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.654 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.861 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.85 -23.62 33.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.449 -0.9 . . . . 0.0 110.597 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 8.8 mmm -57.06 -45.95 82.85 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.569 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -66.44 -13.12 60.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.901 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -80.35 -15.88 55.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.818 0.342 . . . . 0.0 110.106 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.81 -2.89 24.46 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.604 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.655 ' HB3' HD12 ' A' ' 42' ' ' LEU . 35.1 m-85 -63.93 170.95 3.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.982 0.42 . . . . 0.0 111.607 -177.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.6 m -106.84 129.15 54.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.532 0.682 . . . . 0.0 112.448 -172.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.515 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.8 p90 -55.64 -33.63 64.23 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.733 -173.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -59.6 -50.36 74.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.375 -177.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.659 ' HB3' HG11 ' A' ' 46' ' ' VAL . 2.5 m-20 -82.15 -23.58 35.51 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.941 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.593 HD13 ' HG2' ' A' ' 15' ' ' MET . 44.3 mt -59.0 -50.41 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.439 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 28' ' ' LEU . 26.0 tm0? -62.03 -36.13 80.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.57 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.695 ' O ' HG22 ' A' ' 29' ' ' VAL . 9.7 ttpp -61.73 -43.44 98.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.179 177.375 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.804 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.94 -41.1 86.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.837 177.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 25' ' ' GLN . 27.6 mt -63.19 -38.31 90.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.891 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.695 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.55 -30.51 49.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.443 -176.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.868 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.13 -24.97 6.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.831 0.824 . . . . 0.0 109.284 174.746 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.841 ' CB ' ' HB3' ' A' ' 37' ' ' MET . . . -87.72 3.96 45.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.459 -175.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 2.2 pm0 43.67 40.15 2.82 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.532 0.682 . . . . 0.0 110.226 -171.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.2 m120 61.47 39.47 14.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.347 -1.297 . . . . 0.0 112.146 -177.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.462 HD21 ' HA ' ' A' ' 34' ' ' ASN . 3.0 m120 -83.13 140.75 32.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.709 0.29 . . . . 0.0 110.48 172.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.506 HG12 ' HE3' ' A' ' 39' ' ' LYS . 6.0 tt -59.05 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.199 176.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.504 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.4 mt-10 -72.12 -42.78 65.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.935 -175.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.841 ' HB3' ' CB ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER -61.14 -34.17 74.57 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.423 -175.255 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.804 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.27 -52.15 25.13 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.481 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE3' HG12 ' A' ' 35' ' ' ILE . 18.0 ptpt -63.12 -29.21 70.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.722 178.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.1 m-20 -80.52 -39.26 28.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.502 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.868 HG13 HD12 ' A' ' 30' ' ' ILE . 11.0 mm -66.15 -38.24 81.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.186 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.76 -46.35 90.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.636 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 0.1 OUTLIER -53.71 -35.84 61.59 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.475 176.553 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.42 -32.63 22.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.975 0.417 . . . . 0.0 112.077 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 13.7 m-85 -108.46 -76.04 0.62 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -171.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.659 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -98.67 126.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.191 -171.017 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.7 m . . . . . 0 C--N 1.317 -0.846 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.98 -177.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.5 p 49.93 92.41 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.585 0.754 . . . . 0.0 112.611 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.69 85.83 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.419 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.3 p -68.35 127.08 93.29 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.056 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.34 -29.16 26.34 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 123.072 2.515 . . . . 0.0 113.01 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 9' ' ' SER . 52.9 mt-30 -77.27 -41.23 41.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 110.785 -175.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.441 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.3 tm? -66.01 -41.66 90.73 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.131 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.8 t -66.31 -32.55 74.02 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.088 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 38.1 m -63.51 -29.78 71.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.02 173.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 65.4 mm-40 -61.31 -44.89 96.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 176.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 28' ' ' LEU . 53.6 mt -54.76 -49.9 65.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.967 172.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.658 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 23.3 mm-40 -56.91 -28.7 62.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.395 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.51 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 2.8 t-20 -62.33 -51.25 68.37 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.419 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.843 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.72 -24.08 31.36 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.246 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.658 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 25.6 mmm -54.35 -45.63 72.79 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.328 172.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 t -61.92 -21.57 64.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.331 -0.849 . . . . 0.0 110.818 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -82.79 -12.52 57.43 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.705 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 115.54 -10.63 19.21 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.794 176.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.735 ' HB3' HD12 ' A' ' 42' ' ' LEU . 38.4 m-85 -55.07 153.04 6.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.531 . . . . 0.0 112.047 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.5 m -96.4 133.02 41.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.997 -171.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.607 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 42.0 p90 -64.12 -26.07 68.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.51 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.433 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 12.6 pt20 -60.39 -48.28 82.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.253 0.549 . . . . 0.0 110.347 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.516 ' HB3' HG11 ' A' ' 46' ' ' VAL . 7.1 m-20 -80.27 -25.35 39.51 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.495 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 46.6 mt -60.19 -50.2 81.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.517 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 28' ' ' LEU . 23.6 tm0? -62.62 -34.91 78.0 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.721 ' O ' HG22 ' A' ' 29' ' ' VAL . 23.7 ttpt -61.01 -46.41 90.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.155 176.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.616 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -58.17 -39.54 79.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.899 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.4 mt -64.12 -36.86 85.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.896 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.3 m -68.94 -31.25 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.191 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.781 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -87.16 -32.12 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.351 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -86.88 8.73 21.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.944 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.71 54.09 2.5 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.495 0.664 . . . . 0.0 110.68 -174.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 46.8 45.98 15.07 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.663 -174.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 0.7 OUTLIER -77.85 163.49 26.02 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 175.715 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.711 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.5 tt -73.32 -71.9 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.711 ' H ' HG23 ' A' ' 35' ' ' ILE . 50.0 mt-10 -78.1 -35.4 49.3 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.57 -175.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.477 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 31.6 ttm -59.74 -34.5 73.03 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.196 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.19 -52.45 14.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.308 . . . . 0.0 111.657 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.631 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.9 ptpt -62.42 -28.8 70.04 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.905 0.384 . . . . 0.0 110.768 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.95 -38.84 66.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.849 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.781 HG13 HD12 ' A' ' 30' ' ' ILE . 12.4 mm -65.98 -38.6 82.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.194 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.735 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.97 -44.85 94.19 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.276 -0.57 . . . . 0.0 109.491 174.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -45.34 81.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.789 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.09 -39.21 66.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.352 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -101.27 -84.49 0.44 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -170.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.594 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.09 148.45 10.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.905 -171.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 m -117.05 167.85 10.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.998 0.428 . . . . 0.0 111.164 -178.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.2 133.66 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.669 -177.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.6 m -89.89 -12.64 38.35 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.541 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 15.7 p -62.3 130.95 93.52 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.97 -178.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.541 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 3.0 Cg_exo -81.07 137.0 10.59 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 123.416 2.744 . . . . 0.0 112.98 -176.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 55' ' ' ALA . . . 62.07 88.24 0.09 Allowed 'General case' 0 C--O 1.231 0.082 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.047 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -87.16 -56.03 3.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.568 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.5 m -87.67 31.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.141 0.496 . . . . 0.0 111.552 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.566 ' HB2' ' HB1' ' A' ' 52' ' ' ALA . . . -84.32 25.25 0.88 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.988 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 87.3 m . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.358 -0.829 . . . . 0.0 109.386 176.765 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.931 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.821 HG21 ' HB2' ' A' ' 8' ' ' SER . 9.9 t -174.38 139.95 0.62 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.121 0.486 . . . . 0.0 110.652 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.46 -25.57 14.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.393 175.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -99.57 126.76 36.22 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.821 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.22 -32.36 21.0 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 123.165 2.577 . . . . 0.0 112.393 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.29 -32.62 62.96 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.382 0.611 . . . . 0.0 110.407 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 10' ' ' GLU . 1.8 tm? -71.45 -44.61 64.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.721 177.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.821 ' HB2' HG21 ' A' ' 2' ' ' THR . 43.8 t -60.01 -30.72 69.33 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.969 174.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -76.83 -31.52 56.95 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.456 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.36 -38.94 91.58 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.559 HD11 HD11 ' A' ' 28' ' ' LEU . 54.8 mt -57.58 -49.86 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.174 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 48.6 mt-10 -58.98 -26.08 64.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.704 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.89 -49.11 71.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.974 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.813 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.73 -23.67 33.92 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.23 177.928 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.62 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 26.0 mmm -54.3 -42.52 70.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.8 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -64.91 -12.49 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -77.63 -15.11 59.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.048 0.452 . . . . 0.0 110.198 176.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.01 2.2 30.09 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.083 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -62.61 165.64 6.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.018 0.437 . . . . 0.0 111.227 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m -111.09 132.1 54.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.702 -173.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.7 p90 -63.73 -23.66 67.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.597 -172.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.463 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.6 pt20 -59.9 -53.75 54.22 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.955 0.407 . . . . 0.0 111.056 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.463 ' H ' ' HG3' ' A' ' 22' ' ' GLN . 5.3 m-20 -79.56 -25.13 41.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.714 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.745 HG13 HD11 ' A' ' 42' ' ' LEU . 38.9 mt -59.64 -49.28 84.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 109.897 171.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.697 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.7 tt0 -63.86 -35.58 81.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 32.8 ttmt -58.76 -48.74 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.289 175.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -55.64 -40.96 72.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.119 177.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.9 mt -63.35 -38.92 93.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.24 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.88 -30.88 49.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.256 -175.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.675 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -29.11 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.499 0.666 . . . . 0.0 109.396 177.348 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.638 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -89.82 10.5 23.36 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.349 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 44.82 45.02 8.2 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.525 0.678 . . . . 0.0 110.295 -174.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.58 40.51 15.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.998 1.319 . . . . 0.0 112.601 -173.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 9.1 m-20 -76.93 130.68 37.86 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.735 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.518 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.1 tt -57.02 -53.69 39.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.199 1.0 . . . . 0.0 110.195 177.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.496 ' H ' HG23 ' A' ' 35' ' ' ILE . 9.8 pt-20 -68.28 -44.92 74.45 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.939 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.638 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.5 tpt -73.26 -32.95 65.0 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.275 -172.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -67.51 -52.93 33.25 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 2.2 ptpm? -64.02 -29.33 70.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.788 0.328 . . . . 0.0 110.432 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.509 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 41.1 m-20 -70.19 -36.87 74.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.281 175.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.675 HG13 HD12 ' A' ' 30' ' ' ILE . 14.8 mm -67.82 -38.87 80.9 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.552 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.745 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -59.35 -45.26 91.88 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.572 -0.851 . . . . 0.0 109.197 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -42.12 70.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.677 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 21.2 mm-40 -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.323 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HG12 ' A' ' 46' ' ' VAL . 3.6 t80 -99.31 -75.67 0.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.765 0.793 . . . . 0.0 112.607 -166.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -98.33 142.06 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.575 -163.804 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 72.4 p -114.6 171.25 7.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.631 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.81 112.56 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.052 0.453 . . . . 0.0 111.23 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.3 t -153.69 34.28 0.45 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.79 0.805 . . . . 0.0 109.734 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 29.4 m -119.66 134.1 23.86 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.448 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 3.4 Cg_exo -76.3 -171.56 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.912 2.408 . . . . 0.0 111.911 177.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -32.59 72.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.006 0.431 . . . . 0.0 111.092 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.423 ' HB3' ' H ' ' A' ' 54' ' ' VAL . 66.1 m170 -83.06 -149.53 0.09 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.894 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.423 ' H ' ' HB3' ' A' ' 53' ' ' HIS . 42.0 t 70.48 76.45 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.466 0.65 . . . . 0.0 109.886 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -104.67 164.05 12.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.089 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.178 -179.79 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 121.131 0.491 . . . . 0.0 110.162 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.8 m -72.9 -60.56 2.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.68 134.96 7.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.481 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 6' ' ' GLN . 16.1 m -91.3 136.56 26.91 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.762 177.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 4' ' ' SER . 1.7 Cg_endo -46.36 84.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.269 3.979 . . . . 0.0 112.885 173.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 4' ' ' SER . 48.8 mt-30 -86.79 -47.24 9.25 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.974 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 7' ' ' LEU . 1.2 tm? -64.26 -44.95 90.19 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.699 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.0 t -65.62 -24.11 66.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.172 175.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.542 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.6 t -72.24 -32.25 66.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.231 175.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 6' ' ' GLN . 56.6 mm-40 -60.1 -45.15 93.89 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.7 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.699 HD12 ' HA ' ' A' ' 8' ' ' SER . 82.5 mt -51.74 -48.82 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.83 172.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 13.4 mm-40 -62.4 -24.59 67.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.24 -178.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -67.43 -50.42 59.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.343 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.863 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.42 -23.4 50.61 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.686 178.325 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.581 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 20.3 mmm -56.67 -38.17 71.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.626 170.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.7 t -69.49 -10.01 56.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.579 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -88.95 -15.78 33.41 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.9 -7.93 21.65 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.572 177.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.51 ' HB3' HD12 ' A' ' 42' ' ' LEU . 24.8 m-85 -56.13 156.58 5.4 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -174.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.5 m -99.04 137.19 37.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.573 -173.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 33.7 m-85 -59.61 -33.0 70.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.282 -177.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -55.11 -50.81 68.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 111.105 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' HB3' HG11 ' A' ' 46' ' ' VAL . 8.6 m-20 -79.73 -27.37 40.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.401 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.673 HG13 HD11 ' A' ' 42' ' ' LEU . 40.9 mt -56.3 -49.11 78.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.738 0.304 . . . . 0.0 110.448 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.682 ' HA ' HD12 ' A' ' 28' ' ' LEU . 1.4 tm0? -62.03 -38.1 87.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.15 0.5 . . . . 0.0 109.685 176.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.699 ' O ' HG22 ' A' ' 29' ' ' VAL . 29.5 ttmt -57.7 -45.88 85.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.926 176.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.3 -41.1 88.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.028 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.682 HD12 ' HA ' ' A' ' 25' ' ' GLN . 30.7 mt -64.84 -38.44 90.97 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.637 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.699 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -66.61 -32.33 57.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.481 -176.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.673 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -31.86 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.585 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -87.53 9.08 22.21 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.227 -177.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 1.8 pm0 43.1 49.58 5.48 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.191 0.52 . . . . 0.0 110.302 -174.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 46.07 39.71 6.2 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.813 1.245 . . . . 0.0 112.694 -174.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.439 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 1.6 m120 -72.07 156.26 39.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.096 175.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.67 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.1 tt -67.53 -68.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.27 0.557 . . . . 0.0 110.979 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.67 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.0 mt-10 -76.07 -37.43 58.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.764 -174.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.585 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 12.4 tpt -62.3 -38.34 89.03 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.189 -0.605 . . . . 0.0 110.942 -174.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.41 -52.64 37.29 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.5 ptpt -60.98 -31.83 71.41 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.231 0.538 . . . . 0.0 110.698 179.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.496 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 75.1 m-20 -81.58 -28.83 33.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.727 -178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.673 HG13 HD12 ' A' ' 30' ' ' ILE . 9.0 mm -67.19 -39.07 82.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.738 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.251 177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.673 HD11 HG13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -61.06 -47.42 86.44 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.28 174.655 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 56.1 ttp85 -47.08 -44.2 20.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.52 174.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -77.73 -46.31 22.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.554 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.574 ' HB3' HG12 ' A' ' 46' ' ' VAL . 6.1 t80 -82.71 -64.15 1.23 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.665 0.745 . . . . 0.0 112.365 -167.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.574 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.1 OUTLIER -108.06 145.83 14.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.604 -1.18 . . . . 0.0 112.399 -165.029 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 p -114.26 145.76 41.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.279 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.8 mt -88.79 128.32 41.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.976 -172.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.7 p -89.96 -26.69 20.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.787 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.6 m -87.02 129.77 50.78 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.249 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.48 129.09 9.17 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.51 2.14 . . . . 0.0 112.84 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' A' ' 53' ' ' HIS . . . -74.95 163.25 27.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.668 173.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.568 ' HB2' ' O ' ' A' ' 52' ' ' ALA . 37.3 m80 75.84 136.18 0.06 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.627 0.727 . . . . 0.0 110.791 -174.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.7 t -80.75 -23.3 11.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.462 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.77 138.85 31.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.516 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 36.1 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.722 -0.656 . . . . 0.0 109.925 -179.965 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.517 ' HB3' ' HB2' ' A' ' 8' ' ' SER . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 m -88.68 -2.15 58.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.015 0.436 . . . . 0.0 110.735 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.46 -152.52 0.06 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.126 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.5 m -57.71 126.51 76.19 Favored Pre-proline 0 C--O 1.238 0.459 0 CA-C-O 121.109 0.481 . . . . 0.0 110.605 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -63.18 -34.53 68.28 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.615 2.877 . . . . 0.0 113.673 -169.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.606 ' HA ' ' HB2' ' A' ' 9' ' ' SER . 28.0 pt20 -78.05 -29.37 49.23 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.02 0.438 . . . . 0.0 110.994 -173.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.1 -47.25 80.78 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 173.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.517 ' HB2' ' HB3' ' A' ' 1' ' ' ALA . 34.7 t -63.09 -38.37 90.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.179 175.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.606 ' HB2' ' HA ' ' A' ' 6' ' ' GLN . 58.6 m -65.0 -28.17 69.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.553 174.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.47 ' OE1' HG13 ' A' ' 35' ' ' ILE . 1.4 tp10 -66.91 -42.92 84.6 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 HG21 ' A' ' 24' ' ' ILE . 2.0 mp -52.26 -42.85 38.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 121.052 0.453 . . . . 0.0 110.515 169.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 36.3 mt-10 -63.82 -24.02 67.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.348 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -70.52 -50.49 37.24 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.158 -178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.796 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -72.48 -23.99 61.11 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.654 176.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.614 ' N ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -57.18 -34.29 68.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.072 175.262 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -67.06 -13.06 61.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.743 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -85.58 -12.22 52.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.649 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.2 -3.59 29.89 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.417 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' HD12 ' A' ' 42' ' ' LEU . 20.6 m-85 -58.13 157.99 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.479 0.657 . . . . 0.0 112.474 -174.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.491 ' HB2' ' HG2' ' A' ' 22' ' ' GLN . 1.3 p -95.84 135.19 37.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.667 -175.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.62 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 48.3 p90 -66.57 -26.91 67.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.118 -176.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 20' ' ' SER . 8.8 pt20 -63.13 -45.91 89.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.713 0.768 . . . . 0.0 109.954 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.529 ' HB3' HG11 ' A' ' 46' ' ' VAL . 20.9 m-20 -81.13 -29.13 34.86 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.485 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.637 HG13 HD11 ' A' ' 42' ' ' LEU . 39.8 mt -57.44 -48.53 82.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.177 173.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.666 ' HA ' HD12 ' A' ' 28' ' ' LEU . 54.3 tt0 -63.07 -39.94 96.21 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.711 ' O ' HG22 ' A' ' 29' ' ' VAL . 36.4 ttmt -53.88 -47.26 71.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.062 176.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.93 -41.79 92.57 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.328 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 25' ' ' GLN . 31.4 mt -64.95 -36.57 84.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.778 -177.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.0 m -67.1 -30.52 49.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.197 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.842 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.67 -32.92 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-O 121.218 0.533 . . . . 0.0 109.579 174.189 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.598 ' HA ' ' SD ' ' A' ' 37' ' ' MET . . . -82.95 4.3 26.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.765 -177.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.6 OUTLIER 42.49 43.83 3.3 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.602 0.715 . . . . 0.0 110.768 -172.064 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 58.1 49.05 12.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.725 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.597 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 1.2 m-80 -83.59 163.74 20.18 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 173.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.687 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.8 tt -78.4 -64.22 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 121.606 0.717 . . . . 0.0 109.199 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.687 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.2 pt-20 -76.29 -36.89 58.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.264 -174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 31' ' ' ALA . 38.4 ttm -63.79 -29.66 70.84 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.723 0.297 . . . . 0.0 111.204 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.624 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -77.05 -52.83 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.7 ptpt -60.08 -29.89 68.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.05 0.453 . . . . 0.0 110.637 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -75.16 -36.92 61.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.799 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.842 HG13 HD12 ' A' ' 30' ' ' ILE . 10.6 mm -66.48 -38.6 82.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.047 177.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.637 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.66 -49.07 78.9 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.185 174.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.64 -45.77 66.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.477 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.81 -41.21 71.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 111.995 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -93.84 -73.0 0.58 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.48 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.529 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -96.08 139.44 19.17 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.4 -168.59 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 m -114.44 159.37 20.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.518 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.549 ' HB ' ' H ' ' A' ' 50' ' ' SER . 0.0 OUTLIER -108.0 177.21 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.497 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -86.15 5.33 34.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.489 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.549 ' H ' ' HB ' ' A' ' 48' ' ' ILE . 49.3 m -74.19 132.78 78.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.363 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.416 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 45.1 Cg_endo -67.39 -168.9 0.19 Allowed 'Trans proline' 0 C--O 1.235 0.375 0 C-N-CA 123.306 2.671 . . . . 0.0 113.088 -176.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 51' ' ' PRO . . . 75.1 -56.54 0.62 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.516 0.726 . . . . 0.0 110.222 -174.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -98.4 81.25 2.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.8 -42.39 14.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.682 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -172.81 126.91 0.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.026 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.122 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.351 179.04 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 110.49 -0.189 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.5 m -73.62 -41.97 62.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.44 0.638 . . . . 0.0 109.519 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.86 139.72 53.69 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.244 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.632 ' HB2' ' HB2' ' A' ' 8' ' ' SER . 26.6 p -61.57 123.99 79.15 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 121.14 0.495 . . . . 0.0 110.783 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.572 ' HG2' ' OE1' ' A' ' 6' ' ' GLN . 26.9 Cg_endo -93.43 -111.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.079 2.52 . . . . 0.0 115.076 -174.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.572 ' OE1' ' HG2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -78.45 -36.9 44.81 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.108 -163.536 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.6 tm? -59.78 -43.21 94.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.7 t -65.71 -32.17 73.57 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.943 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 74.1 m -63.78 -32.35 73.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.542 176.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.1 mm-40 -64.38 -48.31 75.93 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.768 HG22 ' HG3' ' A' ' 15' ' ' MET . 69.9 mt -52.84 -51.15 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.46 171.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.708 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -57.53 -27.51 62.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.771 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.451 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 3.0 t-20 -60.81 -50.65 72.59 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.544 0.211 . . . . 0.0 110.745 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.845 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.96 -24.42 30.66 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 119.166 -1.013 . . . . 0.0 110.946 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.768 ' HG3' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -60.11 -39.69 87.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.91 175.587 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -66.07 -17.4 64.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.044 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.706 ' OE1' ' HA ' ' A' ' 14' ' ' LEU . 39.5 mt-30 -80.43 -16.82 53.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.964 0.412 . . . . 0.0 110.951 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.72 -2.18 24.61 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.316 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.476 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.3 m-85 -59.08 166.96 1.85 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.17 0.509 . . . . 0.0 111.739 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -104.71 133.98 48.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.992 -172.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.598 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 31.5 p90 -65.16 -28.57 69.5 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.927 -170.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -62.23 -52.14 64.96 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.008 0.432 . . . . 0.0 110.878 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.609 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.4 m-20 -74.74 -25.01 58.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.352 177.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.691 HD13 ' HG2' ' A' ' 15' ' ' MET . 42.1 mt -60.66 -49.5 84.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.002 0.429 . . . . 0.0 110.05 173.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 29.6 tt0 -63.9 -37.31 86.91 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.381 176.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 37.4 ttmt -54.66 -50.61 67.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.035 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -56.64 -41.1 76.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.087 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.0 mt -63.95 -37.93 89.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -68.97 -30.41 46.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.06 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.739 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.61 -27.42 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.139 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.33 10.68 26.4 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.768 -176.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 43.15 46.91 5.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.275 0.56 . . . . 0.0 110.639 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 51.61 33.2 10.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.224 1.41 . . . . 0.0 113.277 -176.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 11.7 m-20 -70.99 149.69 46.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.339 174.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.56 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.2 tt -65.77 -59.69 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-O 121.605 0.716 . . . . 0.0 110.4 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.56 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.3 pt-20 -75.53 -40.48 56.9 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.982 -172.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.591 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 43.0 tpp -67.71 -32.79 73.67 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.886 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.555 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.54 -51.92 37.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.893 0.377 . . . . 0.0 111.808 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.486 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.7 ptpt -62.65 -29.24 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.638 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -77.08 -39.9 48.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.739 HG13 HD12 ' A' ' 30' ' ' ILE . 11.9 mm -63.74 -38.79 83.23 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.402 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.688 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -60.29 -48.5 81.46 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.083 173.812 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -40.9 65.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.667 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.94 -31.99 57.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.028 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 11.4 m-85 -106.48 -80.56 0.56 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.609 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.18 135.27 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.164 -170.819 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.4 p -113.51 165.79 12.14 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.648 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -98.5 134.69 36.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.777 -174.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 t -86.64 -5.09 59.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.166 0.507 . . . . 0.0 110.031 177.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -72.04 140.97 83.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.593 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.49 99.48 0.83 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.82 2.347 . . . . 0.0 112.066 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -112.76 160.51 17.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.439 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -120.48 9.58 10.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.041 177.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.02 134.67 40.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.54 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -152.04 79.92 1.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.909 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.133 -0.937 . . . . 0.0 110.237 -176.728 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.149 0.5 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 19.1 m -85.63 66.08 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.511 0.672 . . . . 0.0 110.062 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.3 -78.87 0.52 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.242 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 19.4 m -118.85 126.06 27.34 Favored Pre-proline 0 N--CA 1.445 -0.677 0 CA-C-O 120.8 0.333 . . . . 0.0 111.115 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 12.9 Cg_exo -73.11 -8.63 22.41 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.123 2.549 . . . . 0.0 111.528 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.527 ' O ' ' HB3' ' A' ' 9' ' ' SER . 47.3 mt-30 -75.61 -39.68 57.56 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.219 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.43 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.4 tm? -67.99 -42.68 80.42 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.552 ' HA ' HD13 ' A' ' 11' ' ' ILE . 38.6 t -65.69 -24.67 67.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.193 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.527 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.1 t -70.0 -30.83 68.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.534 175.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 73.2 mm-40 -58.75 -46.87 86.47 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.701 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -53.09 -50.34 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.779 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 5.7 mm-40 -61.85 -24.68 67.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.665 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 9.6 t-20 -63.87 -50.9 67.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.839 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -80.22 -22.91 41.32 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.956 179.119 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 12.9 mmm -56.58 -38.0 71.38 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.632 171.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -64.79 -12.09 43.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.724 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -92.26 -14.98 28.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.606 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.77 -5.04 22.65 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.73 176.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.742 ' HB3' HD12 ' A' ' 42' ' ' LEU . 41.9 m-85 -59.57 163.77 3.98 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 111.686 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 24' ' ' ILE . 53.4 m -108.78 136.3 48.58 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -171.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.571 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.6 m-85 -57.56 -36.97 72.36 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.638 -174.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.93 -50.17 69.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.919 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.774 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.5 m-20 -81.82 -23.12 36.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.701 HG21 HG23 ' A' ' 11' ' ' ILE . 42.2 mt -58.19 -49.83 80.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.794 0.33 . . . . 0.0 110.188 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.8 tt0 -62.39 -38.17 88.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.342 0.592 . . . . 0.0 109.626 176.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.654 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 20.8 mtpp -58.64 -38.89 79.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.058 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.6 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -66.37 -38.96 88.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.523 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.7 mt -64.11 -37.24 86.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.521 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 26' ' ' LYS . 5.1 m -68.53 -30.89 48.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.344 -177.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.755 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.57 -29.12 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.718 0.771 . . . . 0.0 109.708 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.17 8.44 27.0 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.993 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 40.43 52.0 2.9 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.531 0.681 . . . . 0.0 111.008 -172.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 47.01 44.71 15.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.982 1.313 . . . . 0.0 112.613 -174.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -79.38 154.87 28.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.05 175.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.709 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.0 tt -65.56 -70.6 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.782 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.709 ' H ' HG23 ' A' ' 35' ' ' ILE . 47.6 mm-40 -75.35 -36.89 60.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.618 -173.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.582 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 14.4 tpt -63.02 -36.3 83.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.225 -174.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.36 -52.61 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.921 0.391 . . . . 0.0 111.825 178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.61 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.5 ptpt -62.93 -29.67 70.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.927 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.6 m-20 -78.32 -32.53 49.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.328 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.755 HG13 HD12 ' A' ' 30' ' ' ILE . 13.0 mm -67.4 -38.51 80.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.199 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -58.09 -54.14 50.31 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.928 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 46.8 ttt180 -44.9 -52.82 8.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.563 175.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.87 -44.71 84.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.774 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 20.7 m-85 -99.94 -80.68 0.47 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -85.61 125.91 40.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -172.505 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.2 p -100.28 174.35 6.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.64 -178.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.92 105.44 16.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.611 -177.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.0 m -97.58 4.4 50.27 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.924 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 m -119.22 126.82 26.82 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.757 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.59 -28.12 3.68 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.387 2.058 . . . . 0.0 110.532 168.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -152.47 92.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.511 -1.222 . . . . 0.0 108.425 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -70.92 123.12 21.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.338 -173.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.81 119.81 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.553 0.692 . . . . 0.0 111.282 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -115.74 97.79 6.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.08 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.0 p . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.542 179.659 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 120.957 0.408 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.5 p -85.24 -68.76 0.7 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.285 0.564 . . . . 0.0 110.593 177.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -159.62 156.09 27.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.954 178.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.2 t -75.52 125.21 88.94 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 121.012 0.435 . . . . 0.0 110.538 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.99 -19.92 34.4 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.973 2.449 . . . . 0.0 111.732 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' A' ' 9' ' ' SER . 78.3 mt-30 -83.71 -42.37 16.66 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.66 178.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 33' ' ' ASN . 1.5 tm? -63.36 -49.27 74.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.08 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.733 ' HA ' HD12 ' A' ' 11' ' ' ILE . 30.6 t -56.67 -35.71 68.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 174.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.506 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.6 t -63.98 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.498 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' HB3' ' HA ' ' A' ' 35' ' ' ILE . 2.8 mm-40 -63.48 -48.05 79.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 176.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.733 HD12 ' HA ' ' A' ' 8' ' ' SER . 14.5 mt -59.96 -49.85 82.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.118 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.694 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.1 mt-10 -63.06 -25.19 68.26 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.675 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -62.36 -51.29 68.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.456 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.786 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.19 -24.03 35.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.64 176.605 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.694 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 1.2 mmt -54.12 -29.0 43.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.785 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 t -75.5 -9.69 58.8 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.186 0.517 . . . . 0.0 110.438 -169.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' OE1' ' HA ' ' A' ' 14' ' ' LEU . 1.0 OUTLIER -80.88 -23.82 38.75 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.301 -179.116 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.46 4.8 21.61 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.291 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -61.96 167.79 3.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.054 0.454 . . . . 0.0 111.186 -177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.8 m -104.14 130.71 51.88 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.336 -170.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 10.9 p90 -67.09 -23.64 65.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.519 -170.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.505 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.3 pt20 -59.82 -53.9 52.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.083 0.468 . . . . 0.0 110.578 177.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.731 ' HB3' HG11 ' A' ' 46' ' ' VAL . 1.5 m-20 -82.93 -23.83 33.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.497 -179.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.641 HG13 HD11 ' A' ' 42' ' ' LEU . 24.3 mt -59.86 -50.2 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.644 0.259 . . . . 0.0 110.381 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.746 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.5 tt0 -65.11 -34.73 79.09 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.678 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.0 ttpp -61.34 -40.28 93.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.12 177.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.23 -39.59 95.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.687 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 25' ' ' GLN . 35.7 mt -64.93 -36.59 84.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.494 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.678 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.6 m -69.33 -30.04 44.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.413 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.79 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.37 -31.24 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.585 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.39 11.56 16.54 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.53 -177.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 36.05 43.97 0.23 Allowed 'General case' 0 N--CA 1.474 0.764 0 O-C-N 124.019 0.825 . . . . 0.0 112.316 -171.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.555 ' HB3' HD21 ' A' ' 7' ' ' LEU . 36.3 m-80 68.76 29.73 5.09 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.035 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 14.5 m-20 -72.62 151.13 42.48 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 120.999 0.428 . . . . 0.0 110.603 171.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.821 HG23 ' HG3' ' A' ' 36' ' ' GLU . 11.8 tt -72.79 -53.1 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.363 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.821 ' HG3' HG23 ' A' ' 35' ' ' ILE . 19.2 mt-10 -75.62 -45.26 38.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.98 -175.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 17.4 tpt -63.59 -30.16 71.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 -175.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -75.09 -51.98 12.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.875 176.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HE3' HG12 ' A' ' 35' ' ' ILE . 19.3 ptpt -60.9 -31.16 70.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.002 0.43 . . . . 0.0 110.51 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -69.4 -41.77 75.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.448 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.79 HG13 HD12 ' A' ' 30' ' ' ILE . 14.1 mm -65.83 -38.61 82.6 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.232 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.641 HD11 HG13 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.3 -50.38 73.86 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 172.535 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -53.76 -36.66 62.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.283 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -81.36 -31.09 33.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.015 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 16.7 m-85 -110.31 -79.8 0.58 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.2 -171.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.731 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -97.18 127.27 49.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.049 -173.304 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -125.55 153.52 43.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.709 -175.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.51 141.87 14.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.023 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.3 t -94.72 18.91 10.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.426 0.631 . . . . 0.0 109.568 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.503 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 24.6 t -118.9 129.41 25.41 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.362 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 12.6 Cg_exo -71.37 -12.0 29.18 Favored 'Trans proline' 0 C--O 1.234 0.307 0 C-N-CA 122.779 2.319 . . . . 0.0 112.586 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 69.15 -56.59 0.54 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.665 0.786 . . . . 0.0 112.055 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -74.44 -48.44 27.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.084 0.468 . . . . 0.0 109.947 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 62.4 t -73.48 111.69 8.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.689 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -108.86 -12.16 14.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.471 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.258 178.485 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.5 m 58.44 46.39 15.21 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 110.476 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -162.03 88.68 0.69 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.62 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.5 t -88.0 127.2 58.5 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.983 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.19 -23.41 33.4 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.771 2.314 . . . . 0.0 111.149 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 9' ' ' SER . 93.8 mt-30 -78.72 -37.33 41.75 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.834 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.0 tm? -63.68 -45.8 88.42 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.494 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.4 t -60.11 -35.03 74.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.018 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.2 m -60.98 -29.57 69.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.464 177.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.595 ' HB3' ' HB ' ' A' ' 35' ' ' ILE . 3.5 mm-40 -63.24 -49.47 73.99 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.442 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.7 mp -58.51 -49.3 82.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.42 174.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 50.4 mt-10 -63.51 -24.49 67.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.995 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -61.9 -50.09 73.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.504 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.824 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.15 -23.27 38.39 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.275 178.104 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.637 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 22.4 mmm -57.28 -26.39 60.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.787 177.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.6 p -61.41 -22.78 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.956 0.408 . . . . 0.0 111.104 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -79.62 -20.41 46.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.071 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.83 6.16 26.73 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.511 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -60.4 172.88 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.5 m -112.4 134.47 53.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.468 -170.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.448 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 70.3 m-85 -58.54 -35.37 72.21 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.725 -173.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.486 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 15.5 pt20 -56.35 -54.33 46.77 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.557 0.536 . . . . 0.0 111.724 -176.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.667 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 5.9 m-20 -80.74 -23.56 39.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.724 HG13 HD11 ' A' ' 42' ' ' LEU . 23.8 mt -59.12 -50.08 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.919 0.39 . . . . 0.0 110.084 173.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.727 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.9 tt0 -60.8 -40.77 93.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.533 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 16.1 mtpp -57.66 -43.69 85.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.069 175.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.37 -42.06 98.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.359 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 25' ' ' GLN . 39.2 mt -61.83 -37.28 83.87 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.931 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.5 m -69.03 -30.98 48.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.293 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.804 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.88 -30.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.437 0.637 . . . . 0.0 109.349 175.459 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.621 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.3 12.99 12.55 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.422 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 40.35 52.17 2.86 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.875 0.734 . . . . 0.0 110.88 -176.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.52 51.35 15.52 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.449 -1.25 . . . . 0.0 112.856 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.475 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -93.48 158.77 15.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.36 174.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.625 HG23 ' HG3' ' A' ' 36' ' ' GLU . 6.2 tt -77.44 -60.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.003 176.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.671 ' HA ' ' HG2' ' A' ' 39' ' ' LYS . 3.5 mt-10 -73.49 -43.82 59.26 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.617 -174.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.621 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 16.0 tpt -62.95 -33.98 76.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.35 -175.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.589 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -72.1 -51.95 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.791 176.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.671 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 10.4 ptpt -60.56 -31.22 70.34 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.095 0.474 . . . . 0.0 110.76 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.414 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 75.2 m-20 -78.56 -35.08 46.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.577 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.804 HG13 HD12 ' A' ' 30' ' ' ILE . 11.4 mm -67.12 -38.78 81.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.595 174.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.724 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -58.49 -49.07 78.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.161 172.575 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.01 -33.82 62.94 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.197 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 34.7 mm-40 -83.02 -25.87 31.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.957 0.408 . . . . 0.0 112.007 178.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -110.9 -75.17 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.466 0.65 . . . . 0.0 112.17 -171.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.44 HG11 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -96.84 146.23 7.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.036 -168.26 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.5 p -118.06 171.33 8.16 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.767 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -100.78 144.41 12.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.252 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 45.6 m -92.17 2.63 56.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.582 0.706 . . . . 0.0 109.098 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 17.0 m -110.01 127.66 26.7 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.408 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 21.1 Cg_exo -68.48 -47.69 1.39 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.951 2.434 . . . . 0.0 111.921 177.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 46.21 41.73 9.15 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.604 0.565 . . . . 0.0 111.539 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -97.23 -47.52 5.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.976 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 29.7 m -105.69 23.42 2.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.317 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.14 11.61 18.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.018 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.143 -0.932 . . . . 0.0 109.361 -179.756 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.75 0.31 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.4 t -103.65 47.14 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.847 0.832 . . . . 0.0 110.276 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.84 167.18 26.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.147 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.413 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 21.4 m -78.03 125.67 84.95 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 121.023 0.439 . . . . 0.0 110.145 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 23.8 Cg_exo -65.81 -27.47 51.74 Favored 'Trans proline' 0 C--O 1.221 -0.37 0 C-N-CA 123.336 2.691 . . . . 0.0 112.47 -176.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 9' ' ' SER . 26.3 pt20 -70.47 -33.68 71.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.369 0.604 . . . . 0.0 110.593 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.7 tm? -72.13 -41.81 66.74 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' ' HG2' ' A' ' 12' ' ' GLU . 43.1 t -62.52 -30.75 71.51 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.16 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 54.9 m -60.85 -31.11 70.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.151 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.9 ' HB3' HD13 ' A' ' 35' ' ' ILE . 18.9 mm-40 -60.69 -49.89 75.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.077 0.465 . . . . 0.0 109.794 172.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.507 HG23 HG21 ' A' ' 24' ' ' ILE . 2.8 mp -54.15 -46.08 66.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.611 173.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -59.26 -25.31 63.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.601 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 7.0 t-20 -64.04 -51.76 62.62 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.878 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -78.85 -23.49 44.94 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.136 179.159 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.644 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.19 -39.47 86.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.352 173.662 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.6 t -69.74 -11.92 61.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.154 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -86.32 -22.5 26.71 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.256 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 122.87 -9.3 9.11 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.054 176.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.861 ' HB3' HD12 ' A' ' 42' ' ' LEU . 50.2 m-85 -61.03 162.49 7.05 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.933 0.397 . . . . 0.0 111.933 -175.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -100.82 133.23 45.6 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.417 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 0.3 OUTLIER -54.86 -35.96 64.58 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.92 -172.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -62.87 -51.72 65.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 -175.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.75 ' HB3' HG11 ' A' ' 46' ' ' VAL . 12.7 m-20 -79.08 -23.52 44.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.76 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.575 HD13 ' HG2' ' A' ' 15' ' ' MET . 34.9 mt -58.69 -50.08 80.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 172.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.74 ' HA ' HD12 ' A' ' 28' ' ' LEU . 18.8 tm0? -62.98 -39.66 95.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 43.4 mtpt -57.84 -45.28 86.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.39 175.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.552 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -59.84 -37.59 79.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.83 0.348 . . . . 0.0 110.816 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.2 mt -64.23 -38.59 91.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.872 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -68.79 -30.96 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.77 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.51 -28.43 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.299 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.03 12.22 20.48 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.596 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 43.33 47.68 5.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.447 0.641 . . . . 0.0 110.665 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.63 35.97 12.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.265 1.426 . . . . 0.0 113.34 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.42 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.0 m-20 -77.04 142.23 39.96 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.585 169.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.9 HD13 ' HB3' ' A' ' 10' ' ' GLU . 2.4 tp -68.01 -54.99 18.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-O 121.253 0.549 . . . . 0.0 110.76 174.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.473 ' H ' HG23 ' A' ' 35' ' ' ILE . 25.7 mt-10 -65.75 -48.44 71.87 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.677 -174.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.629 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 53.4 tpp -64.97 -32.31 73.98 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.712 -176.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.552 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.5 -51.88 25.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 16.5 ptpt -62.14 -29.05 70.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.107 0.48 . . . . 0.0 110.149 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.2 -39.56 60.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.014 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.77 HG13 HD12 ' A' ' 30' ' ' ILE . 10.5 mm -63.88 -38.87 83.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.356 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.861 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 172.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -54.71 -34.79 62.88 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.482 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -86.21 -27.6 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.878 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 8.0 m-85 -114.76 -79.37 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.187 0.518 . . . . 0.0 111.956 -174.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -98.02 117.69 43.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.855 -175.154 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.562 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 1.7 p -114.99 -178.37 3.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.502 0.668 . . . . 0.0 111.576 -174.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.04 153.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.225 -173.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.9 t -90.39 51.54 2.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.462 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 25.8 p -74.73 151.15 86.77 Favored Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.047 -175.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 11.9 Cg_exo -71.72 14.99 0.38 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.432 2.755 . . . . 0.0 112.853 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.02 68.18 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.283 0.563 . . . . 0.0 110.547 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.7 p-80 -158.45 158.51 34.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.471 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.8 m -83.25 77.98 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.555 0.693 . . . . 0.0 111.442 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.63 -68.4 0.69 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.436 177.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.8 p . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.589 175.244 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.8 t -134.51 134.3 41.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.332 0.587 . . . . 0.0 111.146 178.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.64 26.73 1.02 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.436 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m -76.05 129.86 79.6 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.57 -178.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.52 ' HB2' ' H ' ' A' ' 6' ' ' GLN . 64.3 Cg_endo -79.06 -136.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.943 2.429 . . . . 0.0 112.704 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.585 ' O ' ' HB2' ' A' ' 9' ' ' SER . 52.4 mt-30 -90.24 -47.17 7.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.421 -170.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 7' ' ' LEU . 1.6 tm? -61.74 -42.1 98.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.11 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -66.93 -24.33 66.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.27 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.585 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 11.7 m -71.07 -31.78 68.28 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.767 176.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.93 -47.19 86.79 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.699 HD11 HD11 ' A' ' 28' ' ' LEU . 87.8 mt -56.19 -53.67 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.755 174.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.574 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 11.5 mm-40 -57.21 -25.84 59.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.958 -176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -66.34 -51.09 60.78 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.867 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.751 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.64 -22.65 43.31 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.811 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 16.6 mmm -53.73 -38.87 64.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.748 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.9 m -71.63 -3.07 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.003 -177.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -87.98 -16.76 32.86 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 -2.68 24.16 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.76 176.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.0 m-85 -61.36 168.57 2.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.191 0.52 . . . . 0.0 111.974 -176.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -113.67 136.08 53.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.119 -169.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.628 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.0 m-85 -59.55 -34.92 73.27 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.139 -174.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -53.61 -50.59 65.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.018 0.437 . . . . 0.0 111.191 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.544 ' HB3' HG11 ' A' ' 46' ' ' VAL . 23.1 m-20 -82.49 -26.86 32.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.784 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.628 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 41.3 mt -60.17 -49.98 82.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.201 0.524 . . . . 0.0 110.398 174.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.735 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.91 -35.49 80.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.961 178.192 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 1.5 ttmm -59.04 -45.98 89.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.829 176.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.497 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.39 -40.6 82.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.95 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.4 mt -62.19 -40.1 94.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.688 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.6 m -67.63 -31.53 52.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.264 -175.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.653 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -27.66 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-O 121.726 0.774 . . . . 0.0 109.265 177.035 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.649 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.94 13.62 18.07 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.434 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 42.15 43.78 2.95 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.643 0.589 . . . . 0.0 111.527 -175.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 55.25 57.05 5.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.795 -175.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 3.7 t-20 -90.26 154.13 19.96 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.494 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.699 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.6 tt -67.3 -64.92 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.913 169.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 35' ' ' ILE . 26.8 mt-10 -71.64 -49.78 36.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.309 -175.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.649 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 3.2 tpt -62.22 -34.58 76.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.342 -168.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -69.68 -52.73 23.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.799 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.603 ' HB3' HD12 ' A' ' 14' ' ' LEU . 1.4 ptpm? -66.01 -29.03 69.33 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.773 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 89.4 m-20 -76.14 -32.64 59.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.205 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.653 HG13 HD12 ' A' ' 30' ' ' ILE . 10.8 mm -68.01 -38.41 79.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.186 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.683 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -57.04 -51.39 69.48 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 172.14 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 21.9 ttp180 -48.45 -48.96 37.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.89 175.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 43.8 mt-10 -77.78 -24.34 48.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.862 -175.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 10.2 m-85 -116.16 -75.92 0.58 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -171.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.683 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -86.37 138.3 19.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.383 -170.567 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -105.58 174.57 5.82 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.433 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -95.55 126.18 48.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 120.895 0.378 . . . . 0.0 111.772 -172.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -72.15 -18.12 61.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -74.8 139.52 73.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.692 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.63 48.47 1.61 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.88 2.387 . . . . 0.0 112.283 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.21 111.35 9.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.698 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -84.13 155.15 22.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.237 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.5 m -94.67 28.95 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.216 0.531 . . . . 0.0 111.317 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.3 87.38 2.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.305 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.341 -178.03 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.003 0 CA-C-O 120.486 0.184 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.8 m 64.77 54.75 1.32 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.75 0.786 . . . . 0.0 110.026 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -135.98 158.41 44.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.849 178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.6 m -59.05 138.71 87.79 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.235 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.485 ' O ' ' HB3' ' A' ' 8' ' ' SER . 17.5 Cg_endo -57.73 -8.82 4.71 Favored 'Trans proline' 0 N--CA 1.476 0.454 0 C-N-CA 123.579 2.853 . . . . 0.0 113.488 -178.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.574 ' O ' ' HB2' ' A' ' 9' ' ' SER . 22.9 mt-30 -71.68 -24.24 61.79 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.576 0.703 . . . . 0.0 110.361 174.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.3 tm? -69.66 -39.06 77.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 170.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.586 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 45.6 t -63.75 -26.68 68.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.807 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.574 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 73.4 m -69.39 -30.79 68.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.999 173.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 4.2 mm-40 -63.0 -34.61 77.92 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.643 HG23 HG21 ' A' ' 24' ' ' ILE . 51.2 mt -55.03 -48.62 75.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.895 171.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.717 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 44.3 mt-10 -58.16 -25.85 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.012 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -64.55 -48.05 76.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.176 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.879 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.06 -24.28 32.8 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.669 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.717 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 23.9 mmm -55.15 -45.6 75.68 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.913 176.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.4 p -68.81 -3.53 12.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.996 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -88.22 -12.88 42.49 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.192 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.69 -8.06 22.02 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.192 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.652 ' HB3' HD12 ' A' ' 42' ' ' LEU . 37.3 m-85 -61.75 157.22 18.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.124 0.488 . . . . 0.0 111.183 -176.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.2 m -100.87 129.51 46.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.338 0.59 . . . . 0.0 111.619 -171.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.713 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.2 p90 -60.71 -26.4 67.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.231 -174.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -59.14 -51.62 69.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.074 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.665 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -82.28 -22.61 35.66 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.024 177.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.713 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 39.6 mt -57.76 -50.24 78.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.83 0.348 . . . . 0.0 110.674 174.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.5 tt0 -61.85 -38.35 87.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.607 0.717 . . . . 0.0 109.529 176.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 34.4 mtpt -61.4 -40.11 93.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.214 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.533 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -65.27 -38.06 89.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.89 176.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.9 mt -63.56 -36.27 83.23 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.651 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -70.04 -30.76 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.102 -177.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.734 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -26.62 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.401 0.619 . . . . 0.0 109.486 175.523 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.27 10.79 28.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 1.5 pm0 43.54 47.18 6.16 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.248 0.546 . . . . 0.0 110.676 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 47.4 43.23 15.23 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.788 1.235 . . . . 0.0 112.89 -174.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -81.68 136.69 35.49 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.61 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.676 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.7 tt -61.31 -48.03 90.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.805 176.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.676 ' HG3' HG23 ' A' ' 35' ' ' ILE . 27.0 mt-10 -72.86 -49.72 28.34 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.134 -174.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 59.6 tpp -67.43 -34.21 76.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.227 -172.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.533 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -64.79 -51.95 59.48 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 178.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -62.51 -29.9 70.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.98 0.419 . . . . 0.0 110.502 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -77.58 -37.12 51.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.734 HG13 HD12 ' A' ' 30' ' ' ILE . 15.4 mm -65.54 -37.82 80.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.544 177.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.801 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -55.43 -57.72 10.71 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.754 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.12 -41.16 16.9 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.292 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.02 -38.87 31.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 17.9 m-85 -101.23 -71.58 0.71 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.334 0.588 . . . . 0.0 112.229 -171.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.801 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -92.09 134.82 29.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.213 -170.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.8 m -104.68 164.25 11.9 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.971 -175.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -159.6 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.641 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.1 t 61.63 38.42 15.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -170.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.534 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 25.1 m -60.9 130.67 91.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.737 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.534 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 2.5 Cg_endo -80.65 174.87 10.65 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.26 2.64 . . . . 0.0 112.771 -174.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 65.75 -86.53 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.351 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -145.6 131.91 19.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.747 -171.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.0 t -124.03 -43.8 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.783 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 57.87 69.96 0.69 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 0.0 112.262 178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 C--O 1.252 1.198 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.892 176.368 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 120.844 0.354 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 21.8 m -83.29 -41.98 17.68 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.777 -177.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.85 68.24 5.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.153 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 p -64.79 126.97 92.08 Favored Pre-proline 0 N--CA 1.447 -0.623 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.543 -176.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.36 -27.53 47.45 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.154 2.569 . . . . 0.0 112.55 -178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' SER . 75.1 mt-30 -72.09 -44.09 63.78 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.272 0.558 . . . . 0.0 110.015 -177.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.409 ' HA ' ' HG2' ' A' ' 10' ' ' GLU . 4.7 tt -60.8 -47.99 83.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.946 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 39.9 t -57.95 -35.26 70.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.492 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.6 m -66.36 -31.96 73.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.507 177.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 6' ' ' GLN . 2.1 mm-40 -62.08 -45.55 93.03 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.583 HG23 HG21 ' A' ' 24' ' ' ILE . 3.4 mp -58.75 -48.99 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.65 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.614 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 46.6 mt-10 -61.15 -26.54 67.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -62.95 -50.37 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.818 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.819 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.02 -23.03 36.16 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.055 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.614 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 10.1 mmm -56.24 -45.73 79.86 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.036 175.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.8 p -72.45 -2.51 19.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.071 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -85.12 -19.06 32.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.29 -3.52 18.41 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.654 177.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 42' ' ' LEU . 45.2 m-85 -64.13 168.76 5.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.008 0.432 . . . . 0.0 111.383 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.9 m -105.95 131.03 53.74 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.262 0.553 . . . . 0.0 111.935 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.2 p90 -61.46 -30.58 70.69 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.945 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 23' ' ' ASP . 22.5 pt20 -56.89 -52.96 63.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.962 0.411 . . . . 0.0 110.981 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.714 ' HB3' HG11 ' A' ' 46' ' ' VAL . 9.2 m-20 -80.87 -23.15 39.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.583 HG21 HG23 ' A' ' 11' ' ' ILE . 54.0 mt -59.26 -50.21 80.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.724 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -66.02 -34.54 78.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.787 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 40.9 mtpt -59.86 -46.35 89.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.985 174.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.74 -38.21 77.91 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.196 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.3 mt -63.57 -37.52 87.63 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -69.65 -30.37 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.14 -177.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.796 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.54 -28.08 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-O 121.448 0.642 . . . . 0.0 109.335 176.413 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.626 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.88 11.99 25.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.565 -176.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 41.85 47.89 3.72 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.456 0.646 . . . . 0.0 110.458 -174.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.5 p30 48.32 40.24 14.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.923 1.289 . . . . 0.0 113.165 -175.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 8.0 m-20 -74.65 148.87 40.27 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.393 171.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.577 HG23 ' H ' ' A' ' 36' ' ' GLU . 3.5 tt -65.33 -59.66 3.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.25 0.548 . . . . 0.0 110.979 173.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.577 ' H ' HG23 ' A' ' 35' ' ' ILE . 44.7 mt-10 -71.3 -45.96 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.015 -173.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.626 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.6 tpt -64.92 -33.22 75.5 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.912 -172.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.502 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.76 -52.42 30.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.725 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HZ3' HD12 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -63.81 -29.98 71.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.095 0.474 . . . . 0.0 110.635 179.002 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -75.56 -35.15 60.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.622 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.796 HG13 HD12 ' A' ' 30' ' ' ILE . 12.6 mm -65.48 -38.32 82.18 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.449 175.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.617 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -59.32 -54.51 45.93 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 171.629 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 tmm_? -52.93 -40.32 63.52 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.91 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.97 -44.31 61.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 111.966 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 29.2 m-85 -100.38 -80.55 0.48 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.67 -172.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.714 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.82 122.03 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.111 -172.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.409 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.8 m -112.45 168.5 9.59 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.553 -176.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -87.11 125.33 40.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.096 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.8 m -101.77 13.72 34.05 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.562 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 51' ' ' PRO . 55.6 p -105.59 170.23 6.13 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.215 -178.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 50' ' ' SER . 4.9 Cg_endo -49.0 -52.2 9.17 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.691 2.261 . . . . 0.0 111.801 174.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.63 -156.11 0.27 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.837 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 76.6 m80 69.23 26.1 5.51 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.5 t -90.24 63.27 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.706 0.765 . . . . 0.0 109.262 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -105.86 56.69 0.67 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.904 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.0 m . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.391 -178.62 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 120.713 0.292 . . . . 0.0 110.613 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 p -79.54 51.78 1.3 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.043 -177.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.63 23.37 9.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.817 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.422 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 15.2 m -69.57 127.37 92.74 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.135 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 26.1 Cg_exo -64.28 -20.12 66.42 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.047 2.498 . . . . 0.0 111.646 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' SER . 23.0 mm-40 -69.92 -35.44 74.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.201 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.0 tm? -68.46 -42.64 78.46 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.1 t -62.49 -29.66 70.7 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.093 175.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.494 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.2 m -67.59 -30.95 70.68 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.531 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.17 -46.13 90.32 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.506 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -54.17 -51.55 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.506 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 63.6 mm-40 -58.84 -26.25 63.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.651 -178.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -62.78 -50.85 69.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.414 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.836 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.87 -23.84 36.1 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.25 177.629 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.704 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -56.21 -32.48 64.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.941 176.542 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 t -59.35 -22.59 61.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.824 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -78.99 -21.53 46.9 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.245 -179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.79 1.65 22.69 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.744 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CG ' HD12 ' A' ' 42' ' ' LEU . 30.9 m-85 -57.62 167.4 1.08 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 112.305 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 p -99.25 135.22 40.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.333 -173.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 7.5 m-85 -62.7 -31.83 72.81 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.17 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -62.17 -48.43 80.12 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.609 0.719 . . . . 0.0 110.504 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.8 ' HB3' HG11 ' A' ' 46' ' ' VAL . 40.4 m-20 -82.75 -29.01 30.02 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.456 -177.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.565 HG13 HD11 ' A' ' 42' ' ' LEU . 23.1 mt -57.14 -49.11 80.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.026 172.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.709 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.3 tt0 -62.49 -39.83 94.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.914 176.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.662 ' O ' HG22 ' A' ' 29' ' ' VAL . 3.2 ttmm -55.63 -42.94 75.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.958 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.568 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -63.99 -41.6 97.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.957 178.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 25' ' ' GLN . 28.6 mt -63.62 -40.23 96.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.463 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.8 m -64.86 -31.21 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.211 -176.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.764 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.97 -32.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.334 0.588 . . . . 0.0 109.58 175.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -85.47 8.68 18.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.234 -177.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER 44.65 40.49 4.14 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.755 0.659 . . . . 0.0 110.999 -175.321 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 61.82 55.32 2.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.38 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.48 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.9 m-20 -103.05 145.0 30.55 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.685 175.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' H ' ' A' ' 36' ' ' GLU . 4.3 tt -62.6 -57.8 10.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.836 0.35 . . . . 0.0 111.384 176.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.535 ' H ' HG23 ' A' ' 35' ' ' ILE . 43.8 mt-10 -68.58 -50.87 48.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.516 -176.043 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.601 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.7 tpt -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.243 -170.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.568 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -71.53 -52.19 19.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.771 0.319 . . . . 0.0 111.822 177.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 1.2 ptpm? -63.89 -28.99 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.907 0.384 . . . . 0.0 110.287 179.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.553 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 97.5 m-20 -76.36 -31.01 57.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.903 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.764 HG13 HD12 ' A' ' 30' ' ' ILE . 13.6 mm -70.57 -38.32 73.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.875 174.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.565 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -60.39 -48.51 81.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 170.88 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 8.7 tpm_? -46.02 -48.91 16.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.287 175.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 33.7 mm-40 -74.72 -43.95 52.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.517 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 23.0 m-85 -97.88 -74.92 0.56 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.592 0.711 . . . . 0.0 112.516 -170.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.8 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -100.44 126.21 54.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.93 -169.539 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 p -99.21 178.19 4.98 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.207 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -85.05 80.33 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-O 121.913 0.864 . . . . 0.0 109.948 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.7 p -87.7 45.71 1.3 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 114.255 -1.339 . . . . 0.0 112.097 -173.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.511 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 47.0 t -107.12 125.21 33.06 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 49.6 Cg_endo -99.42 -1.09 0.87 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.313 2.675 . . . . 0.0 113.008 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 59.75 -167.21 0.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 O-C-N 123.421 0.45 . . . . 0.0 110.014 -174.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -161.29 49.3 0.22 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.23 0.538 . . . . 0.0 110.526 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.42 13.57 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 61.67 20.64 11.5 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.696 -178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.876 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.73 0.3 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.4 m -81.46 130.89 35.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.009 -175.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.81 174.73 0.2 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.437 178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.433 ' HB3' ' HB2' ' A' ' 7' ' ' LEU . 48.0 t -114.29 125.41 29.31 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.378 177.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -67.04 -24.88 44.65 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.831 2.354 . . . . 0.0 111.301 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 6.3 mm-40 -80.82 -35.58 32.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.779 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 7' ' ' LEU . 2.0 tm? -67.76 -42.92 80.97 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.678 173.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 22.7 t -59.79 -33.76 72.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.853 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 11.5 m -64.24 -30.71 71.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.143 176.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.3 mm-40 -60.66 -45.96 92.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 HG21 ' A' ' 24' ' ' ILE . 3.2 mp -56.08 -46.29 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.284 173.123 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 38.8 mt-10 -59.17 -26.5 64.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.093 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -63.38 -51.39 66.06 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.867 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.91 -23.42 41.81 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 119.196 -1.001 . . . . 0.0 110.165 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.61 ' N ' HD22 ' A' ' 14' ' ' LEU . 12.2 mmm -57.94 -35.93 71.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.385 177.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.8 t -73.74 1.23 10.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.657 -177.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -94.24 -18.13 21.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.719 0.295 . . . . 0.0 110.404 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.75 0.35 24.46 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.574 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -63.61 166.99 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.237 0.542 . . . . 0.0 112.192 -176.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -102.01 130.32 48.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.369 -172.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 41.1 p90 -62.85 -30.4 71.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.611 -171.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.556 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 1.5 pt20 -64.32 -49.7 70.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.192 0.52 . . . . 0.0 110.629 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.702 ' HB3' HG11 ' A' ' 46' ' ' VAL . 21.4 m-20 -73.16 -31.1 64.04 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.766 177.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.669 HG13 HD11 ' A' ' 42' ' ' LEU . 39.4 mt -56.53 -48.13 80.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.191 0.519 . . . . 0.0 110.199 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.72 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -64.35 -38.0 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.251 178.287 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.1 ttmt -60.59 -42.83 97.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.322 176.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.591 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -61.72 -36.34 80.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.02 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.72 HD12 ' HA ' ' A' ' 25' ' ' GLN . 41.8 mt -65.77 -39.41 90.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.776 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -67.16 -30.68 50.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.222 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.852 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -85.87 -27.24 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.94 10.69 30.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.416 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER 45.88 39.24 5.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.526 0.679 . . . . 0.0 111.109 -174.55 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m120 62.18 48.26 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.96 -177.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.461 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 77.2 m-20 -94.13 150.68 20.11 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.634 173.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.769 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.6 tt -70.6 -53.63 21.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.341 0.591 . . . . 0.0 110.835 175.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.769 ' HG3' HG23 ' A' ' 35' ' ' ILE . 25.4 mt-10 -71.65 -46.02 60.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.417 -172.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.654 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 49.5 tpp -68.25 -31.04 70.23 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.818 0.342 . . . . 0.0 110.861 -174.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.591 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.73 -51.62 26.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.724 177.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 ptpt -61.06 -29.61 69.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.401 . . . . 0.0 110.517 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 14.3 m-80 -77.4 -34.63 54.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.801 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.852 HG13 HD12 ' A' ' 30' ' ' ILE . 13.2 mm -67.62 -37.65 79.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.711 176.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.669 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.53 -50.37 74.02 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.638 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -53.77 -28.95 37.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.394 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 30.2 mt-10 -89.28 -41.3 12.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.261 0.553 . . . . 0.0 111.731 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -95.34 -74.6 0.55 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.82 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.702 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -102.3 126.72 56.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.562 0.696 . . . . 0.0 112.745 -169.902 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.6 p -104.57 169.95 8.17 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.3 84.25 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.748 . . . . 0.0 109.855 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.7 t -108.68 34.2 3.8 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.308 -177.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.444 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 6.0 p -82.59 142.39 46.02 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.36 175.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 11.8 Cg_exo -71.2 59.17 2.35 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.1 2.533 . . . . 0.0 112.821 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.7 -17.93 39.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.246 178.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 12.9 p80 35.75 74.86 0.07 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.185 0.994 . . . . 0.0 112.419 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.1 m -82.78 128.22 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.089 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -112.35 115.94 29.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.833 -177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.948 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.764 178.781 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.539 HG22 ' HG ' ' A' ' 7' ' ' LEU . 7.6 t -145.38 -9.77 0.56 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.734 0.302 . . . . 0.0 111.164 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.01 13.89 8.04 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.463 ' H ' HG23 ' A' ' 2' ' ' THR . 85.2 p -85.53 139.91 35.9 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-O 121.349 0.595 . . . . 0.0 110.172 176.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 32.2 Cg_exo -59.46 -27.13 84.19 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.435 2.756 . . . . 0.0 112.742 -177.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 9' ' ' SER . 86.9 mm-40 -74.86 -37.97 62.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.907 0.384 . . . . 0.0 110.681 179.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.539 ' HG ' HG22 ' A' ' 2' ' ' THR . 2.1 tm? -61.84 -47.05 86.79 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 173.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 42.7 t -57.58 -35.98 71.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.045 174.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.3 m -63.4 -31.01 72.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.617 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.4 mm-40 -61.18 -48.8 79.87 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.509 HG23 HG21 ' A' ' 24' ' ' ILE . 3.5 mp -55.53 -48.66 77.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.475 173.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.68 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.2 mt-10 -60.68 -25.87 66.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.25 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.586 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 5.5 t-20 -61.13 -51.53 68.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.654 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.861 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.85 -23.62 33.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.449 -0.9 . . . . 0.0 110.597 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 8.8 mmm -57.06 -45.95 82.85 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.569 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -66.44 -13.12 60.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.901 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -80.35 -15.88 55.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.818 0.342 . . . . 0.0 110.106 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.81 -2.89 24.46 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.604 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.655 ' HB3' HD12 ' A' ' 42' ' ' LEU . 35.1 m-85 -63.93 170.95 3.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.982 0.42 . . . . 0.0 111.607 -177.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.6 m -106.84 129.15 54.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.532 0.682 . . . . 0.0 112.448 -172.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.515 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.8 p90 -55.64 -33.63 64.23 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.733 -173.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -59.6 -50.36 74.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.375 -177.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.659 ' HB3' HG11 ' A' ' 46' ' ' VAL . 2.5 m-20 -82.15 -23.58 35.51 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.941 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.593 HD13 ' HG2' ' A' ' 15' ' ' MET . 44.3 mt -59.0 -50.41 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.439 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 28' ' ' LEU . 26.0 tm0? -62.03 -36.13 80.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.57 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.695 ' O ' HG22 ' A' ' 29' ' ' VAL . 9.7 ttpp -61.73 -43.44 98.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.179 177.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.804 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.94 -41.1 86.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.837 177.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 25' ' ' GLN . 27.6 mt -63.19 -38.31 90.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.891 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.695 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.55 -30.51 49.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.443 -176.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.868 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.13 -24.97 6.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.831 0.824 . . . . 0.0 109.284 174.746 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.841 ' CB ' ' HB3' ' A' ' 37' ' ' MET . . . -87.72 3.96 45.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.459 -175.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 2.2 pm0 43.67 40.15 2.82 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.532 0.682 . . . . 0.0 110.226 -171.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.2 m120 61.47 39.47 14.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.347 -1.297 . . . . 0.0 112.146 -177.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.462 HD21 ' HA ' ' A' ' 34' ' ' ASN . 3.0 m120 -83.13 140.75 32.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.709 0.29 . . . . 0.0 110.48 172.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.506 HG12 ' HE3' ' A' ' 39' ' ' LYS . 6.0 tt -59.05 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.199 176.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.504 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.4 mt-10 -72.12 -42.78 65.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.935 -175.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.841 ' HB3' ' CB ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER -61.14 -34.17 74.57 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.423 -175.255 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.804 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.27 -52.15 25.13 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.481 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE3' HG12 ' A' ' 35' ' ' ILE . 18.0 ptpt -63.12 -29.21 70.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.722 178.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.1 m-20 -80.52 -39.26 28.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.502 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.868 HG13 HD12 ' A' ' 30' ' ' ILE . 11.0 mm -66.15 -38.24 81.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.186 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.76 -46.35 90.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.636 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 0.1 OUTLIER -53.71 -35.84 61.59 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.475 176.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.42 -32.63 22.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.975 0.417 . . . . 0.0 112.077 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 13.7 m-85 -108.46 -76.04 0.62 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -171.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.659 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -98.67 126.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.191 -171.017 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.7 m -100.24 176.16 5.48 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.98 -177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.422 HG22 ' H ' ' A' ' 49' ' ' SER . 0.5 OUTLIER -92.37 -154.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.903 -176.419 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.422 ' H ' HG22 ' A' ' 48' ' ' ILE . 66.2 m 60.66 46.9 8.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.419 0.628 . . . . 0.0 110.967 -175.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.505 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 20.7 p -82.59 128.55 66.13 Favored Pre-proline 0 N--CA 1.45 -0.455 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.975 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 1.1 Cg_endo -85.09 -86.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.798 2.332 . . . . 0.0 113.103 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.95 157.9 42.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.458 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 55.34 55.72 7.14 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.919 0.762 . . . . 0.0 109.674 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.45 HG11 ' HB2' ' A' ' 50' ' ' SER . 34.4 m -86.67 -2.02 7.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.635 -170.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.72 -74.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t . . . . . 0 C--O 1.251 1.174 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.244 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.441 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.3 tm? . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.8 t -66.31 -32.55 74.02 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.088 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.1 m -63.51 -29.78 71.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.02 173.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 65.4 mm-40 -61.31 -44.89 96.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 176.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 28' ' ' LEU . 53.6 mt -54.76 -49.9 65.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.967 172.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.658 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 23.3 mm-40 -56.91 -28.7 62.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.395 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.51 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 2.8 t-20 -62.33 -51.25 68.37 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.419 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.843 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.72 -24.08 31.36 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.246 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.658 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 25.6 mmm -54.35 -45.63 72.79 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.328 172.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 t -61.92 -21.57 64.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.331 -0.849 . . . . 0.0 110.818 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' A' ' 14' ' ' LEU . 18.7 mt-30 -82.79 -12.52 57.43 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.705 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 115.54 -10.63 19.21 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.794 176.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.735 ' HB3' HD12 ' A' ' 42' ' ' LEU . 38.4 m-85 -55.07 153.04 6.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.531 . . . . 0.0 112.047 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.5 m -96.4 133.02 41.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.997 -171.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.607 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 42.0 p90 -64.12 -26.07 68.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.51 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.433 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 12.6 pt20 -60.39 -48.28 82.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.253 0.549 . . . . 0.0 110.347 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.516 ' HB3' HG11 ' A' ' 46' ' ' VAL . 7.1 m-20 -80.27 -25.35 39.51 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.495 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 46.6 mt -60.19 -50.2 81.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.517 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.62 -34.91 78.0 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.721 ' O ' HG22 ' A' ' 29' ' ' VAL . 23.7 ttpt -61.01 -46.41 90.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.155 176.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.616 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -58.17 -39.54 79.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.899 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.4 mt -64.12 -36.86 85.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.896 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.3 m -68.94 -31.25 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.191 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.781 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -87.16 -32.12 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -86.88 8.73 21.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.944 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.71 54.09 2.5 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.495 0.664 . . . . 0.0 110.68 -174.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 46.8 45.98 15.07 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.663 -174.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 0.6 OUTLIER -77.85 163.49 26.02 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 175.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.711 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.5 tt -73.32 -71.9 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.711 ' H ' HG23 ' A' ' 35' ' ' ILE . 50.0 mt-10 -78.1 -35.4 49.3 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.57 -175.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.477 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 31.6 ttm -59.74 -34.5 73.03 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.196 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.19 -52.45 14.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.308 . . . . 0.0 111.657 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.631 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.9 ptpt -62.42 -28.8 70.04 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.905 0.384 . . . . 0.0 110.768 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.95 -38.84 66.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.849 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.781 HG13 HD12 ' A' ' 30' ' ' ILE . 12.4 mm -65.98 -38.6 82.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.194 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.735 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.97 -44.85 94.19 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.276 -0.57 . . . . 0.0 109.491 174.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -45.34 81.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.789 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.09 -39.21 66.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.352 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -101.27 -84.49 0.44 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -170.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.594 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.09 148.45 10.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.905 -171.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--N 1.322 -0.627 0 CA-C-O 120.998 0.428 . . . . 0.0 111.164 -178.297 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 10' ' ' GLU . 1.8 tm? . . . . . 0 C--O 1.223 -0.323 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 43.8 t -60.01 -30.72 69.33 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.969 174.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -76.83 -31.52 56.95 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.456 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.36 -38.94 91.58 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.559 HD11 HD11 ' A' ' 28' ' ' LEU . 54.8 mt -57.58 -49.86 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.174 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 48.6 mt-10 -58.98 -26.08 64.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.704 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.416 ' C ' HD22 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -64.89 -49.11 71.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.974 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.813 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.73 -23.67 33.92 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.23 177.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.62 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 26.0 mmm -54.3 -42.52 70.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.8 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -64.91 -12.49 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.712 HE21 ' HA ' ' A' ' 14' ' ' LEU . 49.3 mt-30 -77.63 -15.11 59.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.048 0.452 . . . . 0.0 110.198 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.01 2.2 30.09 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.083 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -62.61 165.64 6.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.018 0.437 . . . . 0.0 111.227 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m -111.09 132.1 54.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.702 -173.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.7 p90 -63.73 -23.66 67.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.597 -172.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.463 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.6 pt20 -59.9 -53.75 54.22 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.955 0.407 . . . . 0.0 111.056 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.463 ' H ' ' HG3' ' A' ' 22' ' ' GLN . 5.3 m-20 -79.56 -25.13 41.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.714 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.745 HG13 HD11 ' A' ' 42' ' ' LEU . 38.9 mt -59.64 -49.28 84.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 109.897 171.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.697 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.7 tt0 -63.86 -35.58 81.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 32.8 ttmt -58.76 -48.74 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.289 175.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -55.64 -40.96 72.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.119 177.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.9 mt -63.35 -38.92 93.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.24 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.88 -30.88 49.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.256 -175.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.675 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -29.11 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.499 0.666 . . . . 0.0 109.396 177.348 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.638 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -89.82 10.5 23.36 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.349 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 44.82 45.02 8.2 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.525 0.678 . . . . 0.0 110.295 -174.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.58 40.51 15.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.998 1.319 . . . . 0.0 112.601 -173.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 9.1 m-20 -76.93 130.68 37.86 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.735 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.518 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.1 tt -57.02 -53.69 39.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.199 1.0 . . . . 0.0 110.195 177.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.496 ' H ' HG23 ' A' ' 35' ' ' ILE . 9.8 pt-20 -68.28 -44.92 74.45 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.939 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.638 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.5 tpt -73.26 -32.95 65.0 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.275 -172.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -67.51 -52.93 33.25 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 2.2 ptpm? -64.02 -29.33 70.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.788 0.328 . . . . 0.0 110.432 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.509 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 41.1 m-20 -70.19 -36.87 74.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.281 175.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.675 HG13 HD12 ' A' ' 30' ' ' ILE . 14.8 mm -67.82 -38.87 80.9 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.552 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.745 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -59.35 -45.26 91.88 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.572 -0.851 . . . . 0.0 109.197 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -42.12 70.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.677 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 21.2 mm-40 -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.323 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HG12 ' A' ' 46' ' ' VAL . 3.6 t80 -99.31 -75.67 0.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.765 0.793 . . . . 0.0 112.607 -166.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -98.33 142.06 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.575 -163.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.631 177.114 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 7' ' ' LEU . 1.2 tm? . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.699 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.0 t -65.62 -24.11 66.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.172 175.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -72.24 -32.25 66.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.231 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -60.1 -45.15 93.89 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.7 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.699 HD12 ' HA ' ' A' ' 8' ' ' SER . 82.5 mt -51.74 -48.82 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.83 172.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 13.4 mm-40 -62.4 -24.59 67.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.24 -178.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -67.43 -50.42 59.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.343 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.863 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.42 -23.4 50.61 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.686 178.325 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.581 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 20.3 mmm -56.67 -38.17 71.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.626 170.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.7 t -69.49 -10.01 56.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.579 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -88.95 -15.78 33.41 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.9 -7.93 21.65 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.572 177.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.51 ' HB3' HD12 ' A' ' 42' ' ' LEU . 24.8 m-85 -56.13 156.58 5.4 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -174.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.5 m -99.04 137.19 37.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.573 -173.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 33.7 m-85 -59.61 -33.0 70.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.282 -177.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -55.11 -50.81 68.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 111.105 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.419 ' HB3' HG11 ' A' ' 46' ' ' VAL . 8.6 m-20 -79.73 -27.37 40.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.401 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.673 HG13 HD11 ' A' ' 42' ' ' LEU . 40.9 mt -56.3 -49.11 78.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.738 0.304 . . . . 0.0 110.448 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.682 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.03 -38.1 87.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.15 0.5 . . . . 0.0 109.685 176.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.699 ' O ' HG22 ' A' ' 29' ' ' VAL . 29.5 ttmt -57.7 -45.88 85.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.926 176.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.3 -41.1 88.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.028 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.682 HD12 ' HA ' ' A' ' 25' ' ' GLN . 30.7 mt -64.84 -38.44 90.97 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.637 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.699 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -66.61 -32.33 57.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.481 -176.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.673 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -31.86 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.585 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -87.53 9.08 22.21 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.227 -177.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.633 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.8 pm0 43.1 49.58 5.48 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.191 0.52 . . . . 0.0 110.302 -174.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 46.07 39.71 6.2 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.813 1.245 . . . . 0.0 112.694 -174.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.633 ' ND2' HE21 ' A' ' 32' ' ' GLN . 35.6 m-20 -72.07 156.26 39.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.096 175.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.67 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.1 tt -67.53 -68.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.27 0.557 . . . . 0.0 110.979 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.67 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.0 mt-10 -76.07 -37.43 58.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.764 -174.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.585 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 12.4 tpt -62.3 -38.34 89.03 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.189 -0.605 . . . . 0.0 110.942 -174.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.41 -52.64 37.29 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.5 ptpt -60.98 -31.83 71.41 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.231 0.538 . . . . 0.0 110.698 179.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.496 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 75.1 m-20 -81.58 -28.83 33.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.727 -178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.673 HG13 HD12 ' A' ' 30' ' ' ILE . 9.0 mm -67.19 -39.07 82.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.738 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.251 177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.673 HD11 HG13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -61.06 -47.42 86.44 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.28 174.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 56.1 ttp85 -47.08 -44.2 20.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.52 174.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -77.73 -46.31 22.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.554 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.574 ' HB3' HG12 ' A' ' 46' ' ' VAL . 6.1 t80 -82.71 -64.15 1.23 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.665 0.745 . . . . 0.0 112.365 -167.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.574 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.1 OUTLIER -108.06 145.83 14.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.604 -1.18 . . . . 0.0 112.399 -165.029 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 C--N 1.319 -0.757 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.279 175.599 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--O 1.224 -0.253 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -63.09 -38.37 90.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.179 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.447 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 58.6 m -65.0 -28.17 69.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.553 174.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.47 ' OE1' HG13 ' A' ' 35' ' ' ILE . 1.4 tp10 -66.91 -42.92 84.6 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 HG21 ' A' ' 24' ' ' ILE . 2.0 mp -52.26 -42.85 38.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 121.052 0.453 . . . . 0.0 110.515 169.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 36.3 mt-10 -63.82 -24.02 67.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.348 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -70.52 -50.49 37.24 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.158 -178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.796 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -72.48 -23.99 61.11 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.654 176.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.614 ' N ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -57.18 -34.29 68.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.072 175.262 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -67.06 -13.06 61.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.743 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.587 HE21 ' HA ' ' A' ' 14' ' ' LEU . 46.4 mt-30 -85.58 -12.22 52.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.649 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.2 -3.59 29.89 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.417 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' HD12 ' A' ' 42' ' ' LEU . 20.6 m-85 -58.13 157.99 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.479 0.657 . . . . 0.0 112.474 -174.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.491 ' HB2' ' HG2' ' A' ' 22' ' ' GLN . 1.3 p -95.84 135.19 37.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.667 -175.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.62 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 48.3 p90 -66.57 -26.91 67.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.118 -176.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 20' ' ' SER . 8.8 pt20 -63.13 -45.91 89.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.713 0.768 . . . . 0.0 109.954 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.529 ' HB3' HG11 ' A' ' 46' ' ' VAL . 20.9 m-20 -81.13 -29.13 34.86 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.485 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.637 HG13 HD11 ' A' ' 42' ' ' LEU . 39.8 mt -57.44 -48.53 82.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.177 173.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.666 ' HA ' HD12 ' A' ' 28' ' ' LEU . 54.3 tt0 -63.07 -39.94 96.21 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.711 ' O ' HG22 ' A' ' 29' ' ' VAL . 36.4 ttmt -53.88 -47.26 71.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.062 176.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.93 -41.79 92.57 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.328 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 25' ' ' GLN . 31.4 mt -64.95 -36.57 84.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.778 -177.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.0 m -67.1 -30.52 49.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.197 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.842 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.67 -32.92 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-O 121.218 0.533 . . . . 0.0 109.579 174.189 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.598 ' HA ' ' SD ' ' A' ' 37' ' ' MET . . . -82.95 4.3 26.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.765 -177.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.496 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 42.49 43.83 3.3 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.602 0.715 . . . . 0.0 110.768 -172.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 58.1 49.05 12.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.725 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.597 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 1.2 m-80 -83.59 163.74 20.18 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 173.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.687 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.8 tt -78.4 -64.22 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 121.606 0.717 . . . . 0.0 109.199 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.687 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.2 pt-20 -76.29 -36.89 58.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.264 -174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 31' ' ' ALA . 38.4 ttm -63.79 -29.66 70.84 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.723 0.297 . . . . 0.0 111.204 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.624 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -77.05 -52.83 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.7 ptpt -60.08 -29.89 68.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.05 0.453 . . . . 0.0 110.637 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -75.16 -36.92 61.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.799 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.842 HG13 HD12 ' A' ' 30' ' ' ILE . 10.6 mm -66.48 -38.6 82.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.047 177.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.637 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.66 -49.07 78.9 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.185 174.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.64 -45.77 66.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.477 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.81 -41.21 71.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 111.995 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -93.84 -73.0 0.58 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.48 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.529 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -96.08 139.44 19.17 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.4 -168.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.518 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.489 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 CA--C 1.523 -0.087 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.7 t -65.71 -32.17 73.57 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.943 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.1 m -63.78 -32.35 73.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.542 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.1 mm-40 -64.38 -48.31 75.93 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.768 HG22 ' HG3' ' A' ' 15' ' ' MET . 69.9 mt -52.84 -51.15 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.46 171.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.708 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -57.53 -27.51 62.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.771 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.451 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 3.0 t-20 -60.81 -50.65 72.59 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.544 0.211 . . . . 0.0 110.745 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.967 ' HA ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -83.96 -24.42 30.66 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 119.166 -1.013 . . . . 0.0 110.946 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.768 ' HG3' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -60.11 -39.69 87.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.91 175.587 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -66.07 -17.4 64.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.044 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.967 HE21 ' HA ' ' A' ' 14' ' ' LEU . 40.7 mt-30 -80.43 -16.82 53.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.964 0.412 . . . . 0.0 110.951 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.72 -2.18 24.61 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.316 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.476 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.3 m-85 -59.08 166.96 1.85 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.17 0.509 . . . . 0.0 111.739 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -104.71 133.98 48.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.992 -172.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.598 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 31.5 p90 -65.16 -28.57 69.5 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.927 -170.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -62.23 -52.14 64.96 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.008 0.432 . . . . 0.0 110.878 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.609 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.4 m-20 -74.74 -25.01 58.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.352 177.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.691 HD13 ' HG2' ' A' ' 15' ' ' MET . 42.1 mt -60.66 -49.5 84.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.002 0.429 . . . . 0.0 110.05 173.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 29.6 tt0 -63.9 -37.31 86.91 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.381 176.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 37.4 ttmt -54.66 -50.61 67.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.035 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -56.64 -41.1 76.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.087 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.0 mt -63.95 -37.93 89.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -68.97 -30.41 46.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.06 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.739 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.61 -27.42 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.139 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.33 10.68 26.4 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.768 -176.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 43.15 46.91 5.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.275 0.56 . . . . 0.0 110.639 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 51.61 33.2 10.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.224 1.41 . . . . 0.0 113.277 -176.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 11.7 m-20 -70.99 149.69 46.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.339 174.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.56 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.2 tt -65.77 -59.69 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-O 121.605 0.716 . . . . 0.0 110.4 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.56 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.3 pt-20 -75.53 -40.48 56.9 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.982 -172.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.591 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 43.0 tpp -67.71 -32.79 73.67 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.886 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.555 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.54 -51.92 37.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.893 0.377 . . . . 0.0 111.808 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.486 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.7 ptpt -62.65 -29.24 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.638 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -77.08 -39.9 48.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.739 HG13 HD12 ' A' ' 30' ' ' ILE . 11.9 mm -63.74 -38.79 83.23 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.402 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.688 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -60.29 -48.5 81.46 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.083 173.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -40.9 65.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.667 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.94 -31.99 57.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.028 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 11.4 m-85 -106.48 -80.56 0.56 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.609 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.18 135.27 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.164 -170.819 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.4 p . . . . . 0 C--N 1.318 -0.781 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.648 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.43 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.4 tm? . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.552 ' HA ' HD13 ' A' ' 11' ' ' ILE . 38.6 t -65.69 -24.67 67.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.193 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.1 t -70.0 -30.83 68.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.534 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 73.2 mm-40 -58.75 -46.87 86.47 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.701 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -53.09 -50.34 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.779 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 5.7 mm-40 -61.85 -24.68 67.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.665 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 9.6 t-20 -63.87 -50.9 67.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.839 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -80.22 -22.91 41.32 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.956 179.119 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 12.9 mmm -56.58 -38.0 71.38 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.632 171.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -64.79 -12.09 43.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.724 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -92.26 -14.98 28.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.606 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.77 -5.04 22.65 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.73 176.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.742 ' HB3' HD12 ' A' ' 42' ' ' LEU . 41.9 m-85 -59.57 163.77 3.98 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 111.686 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 24' ' ' ILE . 53.4 m -108.78 136.3 48.58 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -171.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.571 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.6 m-85 -57.56 -36.97 72.36 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.638 -174.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.93 -50.17 69.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.919 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.774 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.5 m-20 -81.82 -23.12 36.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.701 HG21 HG23 ' A' ' 11' ' ' ILE . 42.2 mt -58.19 -49.83 80.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.794 0.33 . . . . 0.0 110.188 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.8 tt0 -62.39 -38.17 88.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.342 0.592 . . . . 0.0 109.626 176.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.654 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 20.8 mtpp -58.64 -38.89 79.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.058 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.6 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -66.37 -38.96 88.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.523 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.7 mt -64.11 -37.24 86.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.521 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 26' ' ' LYS . 5.1 m -68.53 -30.89 48.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.344 -177.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.755 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.57 -29.12 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.718 0.771 . . . . 0.0 109.708 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.17 8.44 27.0 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.993 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.432 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.2 OUTLIER 40.43 52.0 2.9 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.531 0.681 . . . . 0.0 111.008 -172.607 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 47.01 44.71 15.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.982 1.313 . . . . 0.0 112.613 -174.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -79.38 154.87 28.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.05 175.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.709 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.0 tt -65.56 -70.6 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.782 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.709 ' H ' HG23 ' A' ' 35' ' ' ILE . 47.6 mm-40 -75.35 -36.89 60.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.618 -173.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.582 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 14.4 tpt -63.02 -36.3 83.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.225 -174.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.36 -52.61 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.921 0.391 . . . . 0.0 111.825 178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.61 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.5 ptpt -62.93 -29.67 70.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.927 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.6 m-20 -78.32 -32.53 49.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.328 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.755 HG13 HD12 ' A' ' 30' ' ' ILE . 13.0 mm -67.4 -38.51 80.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.199 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -58.09 -54.14 50.31 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 46.8 ttt180 -44.9 -52.82 8.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.563 175.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.87 -44.71 84.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.774 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 20.7 m-85 -99.94 -80.68 0.47 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -85.61 125.91 40.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -172.505 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.64 -178.561 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.611 HD11 HD22 ' A' ' 33' ' ' ASN . 1.5 tm? . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.733 ' HA ' HD12 ' A' ' 11' ' ' ILE . 30.6 t -56.67 -35.71 68.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 174.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -63.98 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.498 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.482 ' HB3' ' HA ' ' A' ' 35' ' ' ILE . 2.8 mm-40 -63.48 -48.05 79.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 176.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.733 HD12 ' HA ' ' A' ' 8' ' ' SER . 14.5 mt -59.96 -49.85 82.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.118 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.694 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.1 mt-10 -63.06 -25.19 68.26 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.675 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -62.36 -51.29 68.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.456 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.786 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.19 -24.03 35.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.64 176.605 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.694 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 1.2 mmt -54.12 -29.0 43.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.785 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 t -75.5 -9.69 58.8 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.186 0.517 . . . . 0.0 110.438 -169.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.674 HE21 ' HA ' ' A' ' 14' ' ' LEU . 2.3 mp0 -80.88 -23.82 38.75 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.301 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.46 4.8 21.61 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.291 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -61.96 167.79 3.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.054 0.454 . . . . 0.0 111.186 -177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.8 m -104.14 130.71 51.88 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.336 -170.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 10.9 p90 -67.09 -23.64 65.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.519 -170.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.505 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -59.82 -53.9 52.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.083 0.468 . . . . 0.0 110.578 177.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.731 ' HB3' HG11 ' A' ' 46' ' ' VAL . 1.5 m-20 -82.93 -23.83 33.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.497 -179.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.641 HG13 HD11 ' A' ' 42' ' ' LEU . 24.3 mt -59.86 -50.2 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.644 0.259 . . . . 0.0 110.381 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.746 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.5 tt0 -65.11 -34.73 79.09 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.678 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.0 ttpp -61.34 -40.28 93.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.12 177.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.23 -39.59 95.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.687 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 25' ' ' GLN . 35.7 mt -64.93 -36.59 84.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.494 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.678 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.6 m -69.33 -30.04 44.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.413 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.79 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.37 -31.24 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.39 11.56 16.54 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.53 -177.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? 36.05 43.97 0.23 Allowed 'General case' 0 N--CA 1.474 0.764 0 O-C-N 124.019 0.825 . . . . 0.0 112.316 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.611 HD22 HD11 ' A' ' 7' ' ' LEU . 16.0 m120 68.76 29.73 5.09 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.035 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 14.5 m-20 -72.62 151.13 42.48 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 120.999 0.428 . . . . 0.0 110.603 171.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.821 HG23 ' HG3' ' A' ' 36' ' ' GLU . 11.8 tt -72.79 -53.1 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.363 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.821 ' HG3' HG23 ' A' ' 35' ' ' ILE . 19.2 mt-10 -75.62 -45.26 38.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.98 -175.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 17.4 tpt -63.59 -30.16 71.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 -175.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -75.09 -51.98 12.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.875 176.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HE3' HG12 ' A' ' 35' ' ' ILE . 19.3 ptpt -60.9 -31.16 70.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.002 0.43 . . . . 0.0 110.51 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -69.4 -41.77 75.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.448 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.79 HG13 HD12 ' A' ' 30' ' ' ILE . 14.1 mm -65.83 -38.61 82.6 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.232 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.641 HD11 HG13 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.3 -50.38 73.86 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 172.535 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -53.76 -36.66 62.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.283 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -81.36 -31.09 33.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.015 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 16.7 m-85 -110.31 -79.8 0.58 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.2 -171.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.731 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -97.18 127.27 49.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.049 -173.304 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.709 -175.425 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 CA--C 1.523 -0.084 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.4 t -60.11 -35.03 74.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.018 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.2 m -60.98 -29.57 69.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.464 177.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.595 ' HB3' ' HB ' ' A' ' 35' ' ' ILE . 3.5 mm-40 -63.24 -49.47 73.99 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.442 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.7 mp -58.51 -49.3 82.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.42 174.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 50.4 mt-10 -63.51 -24.49 67.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.995 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -61.9 -50.09 73.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.504 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.824 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.15 -23.27 38.39 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.275 178.104 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.637 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 22.4 mmm -57.28 -26.39 60.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.787 177.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.6 p -61.41 -22.78 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.956 0.408 . . . . 0.0 111.104 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -79.62 -20.41 46.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.071 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.83 6.16 26.73 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.511 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -60.4 172.88 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.5 m -112.4 134.47 53.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.468 -170.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.448 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 70.3 m-85 -58.54 -35.37 72.21 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.725 -173.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.486 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -56.35 -54.33 46.77 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.557 0.536 . . . . 0.0 111.724 -176.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.667 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 5.9 m-20 -80.74 -23.56 39.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.724 HG13 HD11 ' A' ' 42' ' ' LEU . 23.8 mt -59.12 -50.08 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.919 0.39 . . . . 0.0 110.084 173.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.727 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.9 tt0 -60.8 -40.77 93.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.533 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 16.1 mtpp -57.66 -43.69 85.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.069 175.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.37 -42.06 98.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.359 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 25' ' ' GLN . 39.2 mt -61.83 -37.28 83.87 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.931 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.5 m -69.03 -30.98 48.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.293 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.804 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.88 -30.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.437 0.637 . . . . 0.0 109.349 175.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.621 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.3 12.99 12.55 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.422 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 40.35 52.17 2.86 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.875 0.734 . . . . 0.0 110.88 -176.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.52 51.35 15.52 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.449 -1.25 . . . . 0.0 112.856 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.475 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -93.48 158.77 15.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.36 174.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.625 HG23 ' HG3' ' A' ' 36' ' ' GLU . 6.2 tt -77.44 -60.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.003 176.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.671 ' HA ' ' HG2' ' A' ' 39' ' ' LYS . 3.5 mt-10 -73.49 -43.82 59.26 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.617 -174.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.621 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 16.0 tpt -62.95 -33.98 76.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.35 -175.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.589 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -72.1 -51.95 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.791 176.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.671 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 10.4 ptpt -60.56 -31.22 70.34 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.095 0.474 . . . . 0.0 110.76 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.414 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 75.2 m-20 -78.56 -35.08 46.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.577 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.804 HG13 HD12 ' A' ' 30' ' ' ILE . 11.4 mm -67.12 -38.78 81.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.595 174.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.724 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -58.49 -49.07 78.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.161 172.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.01 -33.82 62.94 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.197 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 34.7 mm-40 -83.02 -25.87 31.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.957 0.408 . . . . 0.0 112.007 178.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -110.9 -75.17 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.466 0.65 . . . . 0.0 112.17 -171.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.44 HG11 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -96.84 146.23 7.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.036 -168.26 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.5 p . . . . . 0 C--N 1.318 -0.774 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.767 178.662 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.497 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.7 tm? . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' ' HG2' ' A' ' 12' ' ' GLU . 43.1 t -62.52 -30.75 71.51 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.16 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.9 m -60.85 -31.11 70.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.151 174.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.9 ' HB3' HD13 ' A' ' 35' ' ' ILE . 18.9 mm-40 -60.69 -49.89 75.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.077 0.465 . . . . 0.0 109.794 172.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.507 HG23 HG21 ' A' ' 24' ' ' ILE . 2.8 mp -54.15 -46.08 66.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.611 173.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -59.26 -25.31 63.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.601 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 7.0 t-20 -64.04 -51.76 62.62 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.878 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -78.85 -23.49 44.94 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.136 179.159 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.644 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.19 -39.47 86.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.352 173.662 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.6 t -69.74 -11.92 61.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.154 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -86.32 -22.5 26.71 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.256 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 122.87 -9.3 9.11 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.054 176.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.861 ' HB3' HD12 ' A' ' 42' ' ' LEU . 50.2 m-85 -61.03 162.49 7.05 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.933 0.397 . . . . 0.0 111.933 -175.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -100.82 133.23 45.6 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.417 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 0.3 OUTLIER -54.86 -35.96 64.58 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.92 -172.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -62.87 -51.72 65.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 -175.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.75 ' HB3' HG11 ' A' ' 46' ' ' VAL . 12.7 m-20 -79.08 -23.52 44.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.76 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.575 HD13 ' HG2' ' A' ' 15' ' ' MET . 34.9 mt -58.69 -50.08 80.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 172.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.74 ' HA ' HD12 ' A' ' 28' ' ' LEU . 18.8 tm0? -62.98 -39.66 95.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 43.4 mtpt -57.84 -45.28 86.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.39 175.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.552 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -59.84 -37.59 79.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.83 0.348 . . . . 0.0 110.816 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.2 mt -64.23 -38.59 91.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.872 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -68.79 -30.96 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.77 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.51 -28.43 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.03 12.22 20.48 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.596 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 43.33 47.68 5.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.447 0.641 . . . . 0.0 110.665 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.63 35.97 12.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.265 1.426 . . . . 0.0 113.34 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.42 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.0 m-20 -77.04 142.23 39.96 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.585 169.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.9 HD13 ' HB3' ' A' ' 10' ' ' GLU . 2.4 tp -68.01 -54.99 18.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-O 121.253 0.549 . . . . 0.0 110.76 174.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.473 ' H ' HG23 ' A' ' 35' ' ' ILE . 25.7 mt-10 -65.75 -48.44 71.87 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.677 -174.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.629 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 53.4 tpp -64.97 -32.31 73.98 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.712 -176.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.552 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.5 -51.88 25.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 16.5 ptpt -62.14 -29.05 70.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.107 0.48 . . . . 0.0 110.149 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.2 -39.56 60.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.014 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.77 HG13 HD12 ' A' ' 30' ' ' ILE . 10.5 mm -63.88 -38.87 83.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.356 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.861 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 172.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -54.71 -34.79 62.88 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.482 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -86.21 -27.6 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.878 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 8.0 m-85 -114.76 -79.37 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.187 0.518 . . . . 0.0 111.956 -174.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -98.02 117.69 43.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.855 -175.154 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.562 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 1.7 p . . . . . 0 C--N 1.312 -1.024 0 CA-C-O 121.502 0.668 . . . . 0.0 111.576 -174.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.6 tm? . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 121.586 0.708 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -66.93 -24.33 66.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.27 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.7 m -71.07 -31.78 68.28 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.767 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.93 -47.19 86.79 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.699 HD11 HD11 ' A' ' 28' ' ' LEU . 87.8 mt -56.19 -53.67 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.755 174.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.574 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 11.5 mm-40 -57.21 -25.84 59.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.958 -176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -66.34 -51.09 60.78 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.867 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.751 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.64 -22.65 43.31 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.811 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 16.6 mmm -53.73 -38.87 64.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.748 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.9 m -71.63 -3.07 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.003 -177.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -87.98 -16.76 32.86 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 -2.68 24.16 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.76 176.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.0 m-85 -61.36 168.57 2.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.191 0.52 . . . . 0.0 111.974 -176.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -113.67 136.08 53.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.119 -169.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.628 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.0 m-85 -59.55 -34.92 73.27 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.139 -174.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -53.61 -50.59 65.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.018 0.437 . . . . 0.0 111.191 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.544 ' HB3' HG11 ' A' ' 46' ' ' VAL . 23.1 m-20 -82.49 -26.86 32.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.784 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.628 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 41.3 mt -60.17 -49.98 82.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.201 0.524 . . . . 0.0 110.398 174.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.735 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.91 -35.49 80.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.961 178.192 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 1.5 ttmm -59.04 -45.98 89.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.829 176.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.497 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.39 -40.6 82.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.95 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.4 mt -62.19 -40.1 94.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.688 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.6 m -67.63 -31.53 52.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.264 -175.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.653 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -27.66 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-O 121.726 0.774 . . . . 0.0 109.265 177.035 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.649 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.94 13.62 18.07 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.434 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 42.15 43.78 2.95 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.643 0.589 . . . . 0.0 111.527 -175.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 55.25 57.05 5.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.795 -175.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 3.7 t-20 -90.26 154.13 19.96 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.494 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.699 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.6 tt -67.3 -64.92 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.913 169.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 35' ' ' ILE . 26.8 mt-10 -71.64 -49.78 36.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.309 -175.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.649 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 3.2 tpt -62.22 -34.58 76.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.342 -168.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -69.68 -52.73 23.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.799 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.603 ' HB3' HD12 ' A' ' 14' ' ' LEU . 1.4 ptpm? -66.01 -29.03 69.33 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.773 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 89.4 m-20 -76.14 -32.64 59.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.205 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.653 HG13 HD12 ' A' ' 30' ' ' ILE . 10.8 mm -68.01 -38.41 79.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.186 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.683 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -57.04 -51.39 69.48 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 172.14 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 21.9 ttp180 -48.45 -48.96 37.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.89 175.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 43.8 mt-10 -77.78 -24.34 48.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.862 -175.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 10.2 m-85 -116.16 -75.92 0.58 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -171.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.683 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -86.37 138.3 19.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.383 -170.567 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m . . . . . 0 C--N 1.317 -0.825 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.433 176.152 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.3 tm? . . . . . 0 N--CA 1.461 0.125 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.586 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 45.6 t -63.75 -26.68 68.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.807 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.4 m -69.39 -30.79 68.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.999 173.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 4.2 mm-40 -63.0 -34.61 77.92 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.643 HG23 HG21 ' A' ' 24' ' ' ILE . 51.2 mt -55.03 -48.62 75.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.895 171.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.717 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 44.3 mt-10 -58.16 -25.85 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.012 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -64.55 -48.05 76.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.176 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.879 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.06 -24.28 32.8 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.669 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.717 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 23.9 mmm -55.15 -45.6 75.68 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.913 176.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.4 p -68.81 -3.53 12.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.996 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -88.22 -12.88 42.49 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.192 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.69 -8.06 22.02 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.192 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.652 ' HB3' HD12 ' A' ' 42' ' ' LEU . 37.3 m-85 -61.75 157.22 18.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.124 0.488 . . . . 0.0 111.183 -176.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.2 m -100.87 129.51 46.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.338 0.59 . . . . 0.0 111.619 -171.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.713 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.2 p90 -60.71 -26.4 67.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.231 -174.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -59.14 -51.62 69.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.074 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.665 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -82.28 -22.61 35.66 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.024 177.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.713 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 39.6 mt -57.76 -50.24 78.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.83 0.348 . . . . 0.0 110.674 174.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.5 tt0 -61.85 -38.35 87.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.607 0.717 . . . . 0.0 109.529 176.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 34.4 mtpt -61.4 -40.11 93.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.214 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.533 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -65.27 -38.06 89.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.89 176.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.9 mt -63.56 -36.27 83.23 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.651 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -70.04 -30.76 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.102 -177.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.734 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -26.62 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.401 0.619 . . . . 0.0 109.486 175.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.27 10.79 28.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.632 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.5 pm0 43.54 47.18 6.16 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.248 0.546 . . . . 0.0 110.676 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 47.4 43.23 15.23 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.788 1.235 . . . . 0.0 112.89 -174.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.632 ' ND2' HE21 ' A' ' 32' ' ' GLN . 81.2 m-20 -81.68 136.69 35.49 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.61 170.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.676 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.7 tt -61.31 -48.03 90.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.805 176.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.676 ' HG3' HG23 ' A' ' 35' ' ' ILE . 27.0 mt-10 -72.86 -49.72 28.34 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.134 -174.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 59.6 tpp -67.43 -34.21 76.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.227 -172.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.533 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -64.79 -51.95 59.48 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 178.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -62.51 -29.9 70.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.98 0.419 . . . . 0.0 110.502 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -77.58 -37.12 51.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.734 HG13 HD12 ' A' ' 30' ' ' ILE . 15.4 mm -65.54 -37.82 80.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.544 177.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.801 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -55.43 -57.72 10.71 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.12 -41.16 16.9 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.292 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.02 -38.87 31.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 17.9 m-85 -101.23 -71.58 0.71 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.334 0.588 . . . . 0.0 112.229 -171.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.801 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -92.09 134.82 29.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.213 -170.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--N 1.314 -0.97 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.971 -175.9 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.501 HD11 ' ND2' ' A' ' 33' ' ' ASN . 4.7 tt . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 39.9 t -57.95 -35.26 70.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.492 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.6 m -66.36 -31.96 73.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.507 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.409 ' HG2' ' HA ' ' A' ' 7' ' ' LEU . 2.1 mm-40 -62.08 -45.55 93.03 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.583 HG23 HG21 ' A' ' 24' ' ' ILE . 3.4 mp -58.75 -48.99 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.65 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.614 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 46.6 mt-10 -61.15 -26.54 67.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -62.95 -50.37 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.818 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.819 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.02 -23.03 36.16 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.055 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.614 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 10.1 mmm -56.24 -45.73 79.86 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.036 175.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.8 p -72.45 -2.51 19.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.071 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -85.12 -19.06 32.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.29 -3.52 18.41 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.654 177.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 42' ' ' LEU . 45.2 m-85 -64.13 168.76 5.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.008 0.432 . . . . 0.0 111.383 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.9 m -105.95 131.03 53.74 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.262 0.553 . . . . 0.0 111.935 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.2 p90 -61.46 -30.58 70.69 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.945 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 23' ' ' ASP . 22.5 pt20 -56.89 -52.96 63.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.962 0.411 . . . . 0.0 110.981 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.714 ' HB3' HG11 ' A' ' 46' ' ' VAL . 9.2 m-20 -80.87 -23.15 39.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.583 HG21 HG23 ' A' ' 11' ' ' ILE . 54.0 mt -59.26 -50.21 80.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.724 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -66.02 -34.54 78.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.787 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 40.9 mtpt -59.86 -46.35 89.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.985 174.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.74 -38.21 77.91 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.196 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.3 mt -63.57 -37.52 87.63 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -69.65 -30.37 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.14 -177.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.796 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.54 -28.08 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-O 121.448 0.642 . . . . 0.0 109.335 176.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.626 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.88 11.99 25.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.565 -176.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 41.85 47.89 3.72 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.456 0.646 . . . . 0.0 110.458 -174.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.501 ' ND2' HD11 ' A' ' 7' ' ' LEU . 2.4 p-10 48.32 40.24 14.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.923 1.289 . . . . 0.0 113.165 -175.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 8.0 m-20 -74.65 148.87 40.27 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.393 171.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.577 HG23 ' H ' ' A' ' 36' ' ' GLU . 3.5 tt -65.33 -59.66 3.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.25 0.548 . . . . 0.0 110.979 173.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.577 ' H ' HG23 ' A' ' 35' ' ' ILE . 44.7 mt-10 -71.3 -45.96 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.015 -173.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.626 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.6 tpt -64.92 -33.22 75.5 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.912 -172.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.502 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.76 -52.42 30.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.725 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HZ3' HD12 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -63.81 -29.98 71.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.095 0.474 . . . . 0.0 110.635 179.002 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -75.56 -35.15 60.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.622 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.796 HG13 HD12 ' A' ' 30' ' ' ILE . 12.6 mm -65.48 -38.32 82.18 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.449 175.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.617 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -59.32 -54.51 45.93 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 171.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 tmm_? -52.93 -40.32 63.52 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.91 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.97 -44.31 61.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 111.966 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 29.2 m-85 -100.38 -80.55 0.48 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.67 -172.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.714 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.82 122.03 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.111 -172.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.409 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.8 m . . . . . 0 C--N 1.312 -1.052 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.553 -176.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.462 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.1 t -62.49 -29.66 70.7 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.093 175.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.2 m -67.59 -30.95 70.68 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.531 176.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.17 -46.13 90.32 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.506 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -54.17 -51.55 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.506 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 63.6 mm-40 -58.84 -26.25 63.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.651 -178.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -62.78 -50.85 69.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.414 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.836 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.87 -23.84 36.1 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.25 177.629 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.704 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -56.21 -32.48 64.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.941 176.542 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 t -59.35 -22.59 61.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.824 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' A' ' 14' ' ' LEU . 49.5 mt-30 -78.99 -21.53 46.9 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.245 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.79 1.65 22.69 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.744 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CG ' HD12 ' A' ' 42' ' ' LEU . 30.9 m-85 -57.62 167.4 1.08 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 112.305 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 p -99.25 135.22 40.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.333 -173.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.465 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 7.5 m-85 -62.7 -31.83 72.81 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.17 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -62.17 -48.43 80.12 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.609 0.719 . . . . 0.0 110.504 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.8 ' HB3' HG11 ' A' ' 46' ' ' VAL . 40.4 m-20 -82.75 -29.01 30.02 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.456 -177.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.565 HG13 HD11 ' A' ' 42' ' ' LEU . 23.1 mt -57.14 -49.11 80.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.026 172.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.709 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.3 tt0 -62.49 -39.83 94.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.914 176.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.662 ' O ' HG22 ' A' ' 29' ' ' VAL . 3.2 ttmm -55.63 -42.94 75.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.958 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.568 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -63.99 -41.6 97.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.957 178.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 25' ' ' GLN . 28.6 mt -63.62 -40.23 96.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.463 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.8 m -64.86 -31.21 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.211 -176.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.764 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.97 -32.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.334 0.588 . . . . 0.0 109.58 175.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -85.47 8.68 18.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.234 -177.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.466 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 44.65 40.49 4.14 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.755 0.659 . . . . 0.0 110.999 -175.321 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 61.82 55.32 2.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.38 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.48 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.9 m-20 -103.05 145.0 30.55 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.685 175.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' H ' ' A' ' 36' ' ' GLU . 4.3 tt -62.6 -57.8 10.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.836 0.35 . . . . 0.0 111.384 176.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.535 ' H ' HG23 ' A' ' 35' ' ' ILE . 43.8 mt-10 -68.58 -50.87 48.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.516 -176.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.601 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.7 tpt -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.243 -170.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.568 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -71.53 -52.19 19.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.771 0.319 . . . . 0.0 111.822 177.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 1.2 ptpm? -63.89 -28.99 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.907 0.384 . . . . 0.0 110.287 179.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.553 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 97.5 m-20 -76.36 -31.01 57.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.903 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.764 HG13 HD12 ' A' ' 30' ' ' ILE . 13.6 mm -70.57 -38.32 73.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.875 174.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.565 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -60.39 -48.51 81.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 170.88 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 8.7 tpm_? -46.02 -48.91 16.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.287 175.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 33.7 mm-40 -74.72 -43.95 52.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.517 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 23.0 m-85 -97.88 -74.92 0.56 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.592 0.711 . . . . 0.0 112.516 -170.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.8 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -100.44 126.21 54.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.93 -169.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 p . . . . . 0 C--N 1.312 -1.042 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.207 175.831 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.463 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 22.7 t -59.79 -33.76 72.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.853 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.5 m -64.24 -30.71 71.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.143 176.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.3 mm-40 -60.66 -45.96 92.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 HG21 ' A' ' 24' ' ' ILE . 3.2 mp -56.08 -46.29 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.284 173.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 38.8 mt-10 -59.17 -26.5 64.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.093 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -63.38 -51.39 66.06 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.867 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.91 -23.42 41.81 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 119.196 -1.001 . . . . 0.0 110.165 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.61 ' N ' HD22 ' A' ' 14' ' ' LEU . 12.2 mmm -57.94 -35.93 71.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.385 177.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.8 t -73.74 1.23 10.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.657 -177.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -94.24 -18.13 21.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.719 0.295 . . . . 0.0 110.404 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.75 0.35 24.46 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.574 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -63.61 166.99 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.237 0.542 . . . . 0.0 112.192 -176.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -102.01 130.32 48.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.369 -172.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 41.1 p90 -62.85 -30.4 71.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.611 -171.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.556 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 1.5 pt20 -64.32 -49.7 70.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.192 0.52 . . . . 0.0 110.629 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.702 ' HB3' HG11 ' A' ' 46' ' ' VAL . 21.4 m-20 -73.16 -31.1 64.04 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.766 177.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.669 HG13 HD11 ' A' ' 42' ' ' LEU . 39.4 mt -56.53 -48.13 80.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.191 0.519 . . . . 0.0 110.199 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.72 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -64.35 -38.0 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.251 178.287 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.1 ttmt -60.59 -42.83 97.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.322 176.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.591 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -61.72 -36.34 80.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.02 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.72 HD12 ' HA ' ' A' ' 25' ' ' GLN . 41.8 mt -65.77 -39.41 90.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.776 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -67.16 -30.68 50.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.222 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.852 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -85.87 -27.24 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.94 10.69 30.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.416 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 45.88 39.24 5.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.526 0.679 . . . . 0.0 111.109 -174.55 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m120 62.18 48.26 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.96 -177.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.461 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 77.2 m-20 -94.13 150.68 20.11 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.634 173.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.769 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.6 tt -70.6 -53.63 21.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.341 0.591 . . . . 0.0 110.835 175.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.769 ' HG3' HG23 ' A' ' 35' ' ' ILE . 25.4 mt-10 -71.65 -46.02 60.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.417 -172.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.654 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 49.5 tpp -68.25 -31.04 70.23 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.818 0.342 . . . . 0.0 110.861 -174.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.591 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.73 -51.62 26.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.724 177.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 ptpt -61.06 -29.61 69.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.401 . . . . 0.0 110.517 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 14.3 m-80 -77.4 -34.63 54.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.801 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.852 HG13 HD12 ' A' ' 30' ' ' ILE . 13.2 mm -67.62 -37.65 79.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.711 176.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.669 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.53 -50.37 74.02 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -53.77 -28.95 37.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.394 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 30.2 mt-10 -89.28 -41.3 12.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.261 0.553 . . . . 0.0 111.731 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -95.34 -74.6 0.55 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.82 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.702 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -102.3 126.72 56.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.562 0.696 . . . . 0.0 112.745 -169.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 C--N 1.314 -0.944 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.335 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 ' HA ' ' A' ' 7' ' ' LEU . 2.1 tm? . . . . . 0 C--O 1.226 -0.151 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 42.7 t -57.58 -35.98 71.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.045 174.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -63.4 -31.01 72.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.617 177.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.4 mm-40 -61.18 -48.8 79.87 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.509 HG23 HG21 ' A' ' 24' ' ' ILE . 3.5 mp -55.53 -48.66 77.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.475 173.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.68 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.2 mt-10 -60.68 -25.87 66.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.25 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.586 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 5.5 t-20 -61.13 -51.53 68.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.654 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.861 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.85 -23.62 33.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.449 -0.9 . . . . 0.0 110.597 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 8.8 mmm -57.06 -45.95 82.85 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.569 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -66.44 -13.12 60.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.901 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -80.35 -15.88 55.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.818 0.342 . . . . 0.0 110.106 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.81 -2.89 24.46 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.604 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.655 ' HB3' HD12 ' A' ' 42' ' ' LEU . 35.1 m-85 -63.93 170.95 3.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.982 0.42 . . . . 0.0 111.607 -177.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.6 m -106.84 129.15 54.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.532 0.682 . . . . 0.0 112.448 -172.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.515 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.8 p90 -55.64 -33.63 64.23 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.733 -173.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -59.6 -50.36 74.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.375 -177.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.659 ' CB ' HG11 ' A' ' 46' ' ' VAL . 2.5 m-20 -82.15 -23.58 35.51 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.941 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.593 HD13 ' HG2' ' A' ' 15' ' ' MET . 44.3 mt -59.0 -50.41 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.439 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.03 -36.13 80.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.57 176.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.695 ' O ' HG22 ' A' ' 29' ' ' VAL . 9.7 ttpp -61.73 -43.44 98.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.179 177.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.804 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.94 -41.1 86.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.837 177.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 25' ' ' GLN . 27.6 mt -63.19 -38.31 90.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.891 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.695 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.55 -30.51 49.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.443 -176.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.868 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.13 -24.97 6.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.831 0.824 . . . . 0.0 109.284 174.746 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.841 ' CB ' ' HB3' ' A' ' 37' ' ' MET . . . -87.72 3.96 45.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.459 -175.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.55 HE21 ' ND2' ' A' ' 34' ' ' ASN . 2.2 pm0 43.67 40.15 2.82 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.532 0.682 . . . . 0.0 110.226 -171.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.2 m120 61.47 39.47 14.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.347 -1.297 . . . . 0.0 112.146 -177.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.55 ' ND2' HE21 ' A' ' 32' ' ' GLN . 58.2 m-20 -83.13 140.75 32.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.709 0.29 . . . . 0.0 110.48 172.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.506 HG12 ' HE3' ' A' ' 39' ' ' LYS . 6.0 tt -59.05 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.199 176.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.504 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.4 mt-10 -72.12 -42.78 65.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.935 -175.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.841 ' HB3' ' CB ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER -61.14 -34.17 74.57 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.423 -175.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.804 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.27 -52.15 25.13 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.481 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE3' HG12 ' A' ' 35' ' ' ILE . 18.0 ptpt -63.12 -29.21 70.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.722 178.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.1 m-20 -80.52 -39.26 28.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.502 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.868 HG13 HD12 ' A' ' 30' ' ' ILE . 11.0 mm -66.15 -38.24 81.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.186 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.76 -46.35 90.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 0.1 OUTLIER -53.71 -35.84 61.59 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.475 176.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.42 -32.63 22.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.975 0.417 . . . . 0.0 112.077 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 13.7 m-85 -108.46 -76.04 0.62 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -171.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.659 HG11 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -98.67 126.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.191 -171.017 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.7 m . . . . . 0 C--N 1.317 -0.846 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.98 -177.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.5 p 49.93 92.41 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.585 0.754 . . . . 0.0 112.611 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.69 85.83 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.419 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.3 p -68.35 127.08 93.29 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.056 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.34 -29.16 26.34 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 123.072 2.515 . . . . 0.0 113.01 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 9' ' ' SER . 52.9 mt-30 -77.27 -41.23 41.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 110.785 -175.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.441 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.3 tm? -66.01 -41.66 90.73 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.8 t -66.31 -32.55 74.02 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.088 175.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 38.1 m -63.51 -29.78 71.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.02 173.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.51 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 65.4 mm-40 -61.31 -44.89 96.45 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 176.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 28' ' ' LEU . 53.6 mt -54.76 -49.9 65.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.967 172.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.658 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 23.3 mm-40 -56.91 -28.7 62.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.395 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.51 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 2.8 t-20 -62.33 -51.25 68.37 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.419 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.843 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.72 -24.08 31.36 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.246 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.658 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 25.6 mmm -54.35 -45.63 72.79 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.328 172.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 t -61.92 -21.57 64.86 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.331 -0.849 . . . . 0.0 110.818 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' A' ' 14' ' ' LEU . 18.7 mt-30 -82.79 -12.52 57.43 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.705 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 115.54 -10.63 19.21 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.794 176.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.735 ' HB3' HD12 ' A' ' 42' ' ' LEU . 38.4 m-85 -55.07 153.04 6.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.531 . . . . 0.0 112.047 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.5 m -96.4 133.02 41.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.997 -171.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.607 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 42.0 p90 -64.12 -26.07 68.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.51 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.433 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 12.6 pt20 -60.39 -48.28 82.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.253 0.549 . . . . 0.0 110.347 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.516 ' HB3' HG11 ' A' ' 46' ' ' VAL . 7.1 m-20 -80.27 -25.35 39.51 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.495 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 46.6 mt -60.19 -50.2 81.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.517 175.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.62 -34.91 78.0 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.721 ' O ' HG22 ' A' ' 29' ' ' VAL . 23.7 ttpt -61.01 -46.41 90.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.155 176.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.616 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -58.17 -39.54 79.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.899 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.4 mt -64.12 -36.86 85.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.896 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.3 m -68.94 -31.25 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.191 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.781 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -87.16 -32.12 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -86.88 8.73 21.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.153 -0.931 . . . . 0.0 111.944 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.71 54.09 2.5 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.495 0.664 . . . . 0.0 110.68 -174.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 46.8 45.98 15.07 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.663 -174.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 0.6 OUTLIER -77.85 163.49 26.02 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.929 175.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.711 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.5 tt -73.32 -71.9 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.711 ' H ' HG23 ' A' ' 35' ' ' ILE . 50.0 mt-10 -78.1 -35.4 49.3 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.57 -175.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.477 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 31.6 ttm -59.74 -34.5 73.03 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.196 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.19 -52.45 14.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.308 . . . . 0.0 111.657 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.631 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.9 ptpt -62.42 -28.8 70.04 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.905 0.384 . . . . 0.0 110.768 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.95 -38.84 66.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.849 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.781 HG13 HD12 ' A' ' 30' ' ' ILE . 12.4 mm -65.98 -38.6 82.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.194 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.735 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.97 -44.85 94.19 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.276 -0.57 . . . . 0.0 109.491 174.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -45.34 81.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.789 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.09 -39.21 66.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.352 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -101.27 -84.49 0.44 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -170.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.594 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.09 148.45 10.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.905 -171.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.2 m -117.05 167.85 10.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.998 0.428 . . . . 0.0 111.164 -178.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.2 133.66 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.669 -177.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.6 m -89.89 -12.64 38.35 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.541 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 15.7 p -62.3 130.95 93.52 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.97 -178.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.541 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 3.0 Cg_exo -81.07 137.0 10.59 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 123.416 2.744 . . . . 0.0 112.98 -176.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 55' ' ' ALA . . . 62.07 88.24 0.09 Allowed 'General case' 0 C--O 1.231 0.082 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.047 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -87.16 -56.03 3.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.568 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.5 m -87.67 31.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.141 0.496 . . . . 0.0 111.552 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.566 ' HB2' ' HB1' ' A' ' 52' ' ' ALA . . . -84.32 25.25 0.88 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.988 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 87.3 m . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.358 -0.829 . . . . 0.0 109.386 176.765 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.931 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.821 HG21 ' HB2' ' A' ' 8' ' ' SER . 9.9 t -174.38 139.95 0.62 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.121 0.486 . . . . 0.0 110.652 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.46 -25.57 14.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.393 175.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -99.57 126.76 36.22 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.821 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.22 -32.36 21.0 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 123.165 2.577 . . . . 0.0 112.393 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.29 -32.62 62.96 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.382 0.611 . . . . 0.0 110.407 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 10' ' ' GLU . 1.8 tm? -71.45 -44.61 64.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.721 177.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.821 ' HB2' HG21 ' A' ' 2' ' ' THR . 43.8 t -60.01 -30.72 69.33 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.969 174.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -76.83 -31.52 56.95 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.456 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.36 -38.94 91.58 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.559 HD11 HD11 ' A' ' 28' ' ' LEU . 54.8 mt -57.58 -49.86 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.174 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.62 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 48.6 mt-10 -58.98 -26.08 64.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.704 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.416 ' C ' HD22 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -64.89 -49.11 71.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.974 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.813 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.73 -23.67 33.92 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.23 177.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.62 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 26.0 mmm -54.3 -42.52 70.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.8 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -64.91 -12.49 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.712 HE21 ' HA ' ' A' ' 14' ' ' LEU . 49.3 mt-30 -77.63 -15.11 59.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.048 0.452 . . . . 0.0 110.198 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.01 2.2 30.09 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.083 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -62.61 165.64 6.16 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.018 0.437 . . . . 0.0 111.227 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.5 m -111.09 132.1 54.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.702 -173.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.7 p90 -63.73 -23.66 67.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.597 -172.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.463 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 6.6 pt20 -59.9 -53.75 54.22 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.955 0.407 . . . . 0.0 111.056 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.463 ' H ' ' HG3' ' A' ' 22' ' ' GLN . 5.3 m-20 -79.56 -25.13 41.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.714 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.745 HG13 HD11 ' A' ' 42' ' ' LEU . 38.9 mt -59.64 -49.28 84.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 109.897 171.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.697 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.7 tt0 -63.86 -35.58 81.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.678 177.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 32.8 ttmt -58.76 -48.74 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.289 175.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -55.64 -40.96 72.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.119 177.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.9 mt -63.35 -38.92 93.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.24 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.88 -30.88 49.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.256 -175.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.675 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -29.11 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.499 0.666 . . . . 0.0 109.396 177.348 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.638 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -89.82 10.5 23.36 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.349 -176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 44.82 45.02 8.2 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.525 0.678 . . . . 0.0 110.295 -174.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.58 40.51 15.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.998 1.319 . . . . 0.0 112.601 -173.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 9.1 m-20 -76.93 130.68 37.86 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.735 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.518 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.1 tt -57.02 -53.69 39.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.199 1.0 . . . . 0.0 110.195 177.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.496 ' H ' HG23 ' A' ' 35' ' ' ILE . 9.8 pt-20 -68.28 -44.92 74.45 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.939 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.638 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.5 tpt -73.26 -32.95 65.0 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.275 -172.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -67.51 -52.93 33.25 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 2.2 ptpm? -64.02 -29.33 70.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.788 0.328 . . . . 0.0 110.432 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.509 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 41.1 m-20 -70.19 -36.87 74.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.281 175.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.675 HG13 HD12 ' A' ' 30' ' ' ILE . 14.8 mm -67.82 -38.87 80.9 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.552 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.745 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -59.35 -45.26 91.88 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.572 -0.851 . . . . 0.0 109.197 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -42.12 70.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.677 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 21.2 mm-40 -69.55 -41.04 76.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.323 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HG12 ' A' ' 46' ' ' VAL . 3.6 t80 -99.31 -75.67 0.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.765 0.793 . . . . 0.0 112.607 -166.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -98.33 142.06 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.575 -163.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 72.4 p -114.6 171.25 7.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.631 177.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.81 112.56 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.052 0.453 . . . . 0.0 111.23 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.3 t -153.69 34.28 0.45 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.79 0.805 . . . . 0.0 109.734 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 29.4 m -119.66 134.1 23.86 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.448 -178.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 3.4 Cg_exo -76.3 -171.56 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.912 2.408 . . . . 0.0 111.911 177.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -32.59 72.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.006 0.431 . . . . 0.0 111.092 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.423 ' HB3' ' H ' ' A' ' 54' ' ' VAL . 66.1 m170 -83.06 -149.53 0.09 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.894 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.423 ' H ' ' HB3' ' A' ' 53' ' ' HIS . 42.0 t 70.48 76.45 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.466 0.65 . . . . 0.0 109.886 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -104.67 164.05 12.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.089 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.178 -179.79 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 121.131 0.491 . . . . 0.0 110.162 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.8 m -72.9 -60.56 2.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.68 134.96 7.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.481 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 6' ' ' GLN . 16.1 m -91.3 136.56 26.91 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.762 177.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 4' ' ' SER . 1.7 Cg_endo -46.36 84.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.269 3.979 . . . . 0.0 112.885 173.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 4' ' ' SER . 48.8 mt-30 -86.79 -47.24 9.25 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.974 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 7' ' ' LEU . 1.2 tm? -64.26 -44.95 90.19 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.699 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.0 t -65.62 -24.11 66.97 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.172 175.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.542 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.6 t -72.24 -32.25 66.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.231 175.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 6' ' ' GLN . 56.6 mm-40 -60.1 -45.15 93.89 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.7 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.699 HD12 ' HA ' ' A' ' 8' ' ' SER . 82.5 mt -51.74 -48.82 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.83 172.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 13.4 mm-40 -62.4 -24.59 67.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.24 -178.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -67.43 -50.42 59.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.343 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.863 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.42 -23.4 50.61 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.686 178.325 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.581 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 20.3 mmm -56.67 -38.17 71.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.626 170.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.7 t -69.49 -10.01 56.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.579 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -88.95 -15.78 33.41 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.9 -7.93 21.65 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.572 177.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.51 ' HB3' HD12 ' A' ' 42' ' ' LEU . 24.8 m-85 -56.13 156.58 5.4 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -174.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.5 m -99.04 137.19 37.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.573 -173.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 33.7 m-85 -59.61 -33.0 70.93 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.282 -177.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -55.11 -50.81 68.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 0.0 111.105 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.419 ' HB3' HG11 ' A' ' 46' ' ' VAL . 8.6 m-20 -79.73 -27.37 40.58 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.401 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.673 HG13 HD11 ' A' ' 42' ' ' LEU . 40.9 mt -56.3 -49.11 78.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.738 0.304 . . . . 0.0 110.448 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.682 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.03 -38.1 87.42 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.15 0.5 . . . . 0.0 109.685 176.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.699 ' O ' HG22 ' A' ' 29' ' ' VAL . 29.5 ttmt -57.7 -45.88 85.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.926 176.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.3 -41.1 88.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.028 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.682 HD12 ' HA ' ' A' ' 25' ' ' GLN . 30.7 mt -64.84 -38.44 90.97 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.637 -178.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.699 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -66.61 -32.33 57.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.481 -176.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.673 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.49 -31.86 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.585 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -87.53 9.08 22.21 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.227 -177.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.633 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.8 pm0 43.1 49.58 5.48 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.191 0.52 . . . . 0.0 110.302 -174.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 46.07 39.71 6.2 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.813 1.245 . . . . 0.0 112.694 -174.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.633 ' ND2' HE21 ' A' ' 32' ' ' GLN . 35.6 m-20 -72.07 156.26 39.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.096 175.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.67 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.1 tt -67.53 -68.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-O 121.27 0.557 . . . . 0.0 110.979 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.67 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.0 mt-10 -76.07 -37.43 58.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.764 -174.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.585 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 12.4 tpt -62.3 -38.34 89.03 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.189 -0.605 . . . . 0.0 110.942 -174.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.41 -52.64 37.29 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.5 ptpt -60.98 -31.83 71.41 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.231 0.538 . . . . 0.0 110.698 179.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.496 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 75.1 m-20 -81.58 -28.83 33.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.727 -178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.673 HG13 HD12 ' A' ' 30' ' ' ILE . 9.0 mm -67.19 -39.07 82.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.738 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.251 177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.673 HD11 HG13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -61.06 -47.42 86.44 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.28 174.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 56.1 ttp85 -47.08 -44.2 20.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.52 174.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -77.73 -46.31 22.18 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.554 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.574 ' HB3' HG12 ' A' ' 46' ' ' VAL . 6.1 t80 -82.71 -64.15 1.23 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.665 0.745 . . . . 0.0 112.365 -167.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.574 HG12 ' HB3' ' A' ' 45' ' ' PHE . 0.1 OUTLIER -108.06 145.83 14.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 114.604 -1.18 . . . . 0.0 112.399 -165.029 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 p -114.26 145.76 41.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.279 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.8 mt -88.79 128.32 41.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.976 -172.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.7 p -89.96 -26.69 20.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.787 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.6 m -87.02 129.77 50.78 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.249 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -78.48 129.09 9.17 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.51 2.14 . . . . 0.0 112.84 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' A' ' 53' ' ' HIS . . . -74.95 163.25 27.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.668 173.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.568 ' HB2' ' O ' ' A' ' 52' ' ' ALA . 37.3 m80 75.84 136.18 0.06 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.627 0.727 . . . . 0.0 110.791 -174.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.7 t -80.75 -23.3 11.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.462 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.77 138.85 31.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.516 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 36.1 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.722 -0.656 . . . . 0.0 109.925 -179.965 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.517 ' HB3' ' HB2' ' A' ' 8' ' ' SER . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 m -88.68 -2.15 58.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.015 0.436 . . . . 0.0 110.735 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.46 -152.52 0.06 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.126 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.5 m -57.71 126.51 76.19 Favored Pre-proline 0 C--O 1.238 0.459 0 CA-C-O 121.109 0.481 . . . . 0.0 110.605 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -63.18 -34.53 68.28 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.615 2.877 . . . . 0.0 113.673 -169.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.606 ' HA ' ' HB2' ' A' ' 9' ' ' SER . 3.4 pt20 -78.05 -29.37 49.23 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.02 0.438 . . . . 0.0 110.994 -173.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.1 -47.25 80.78 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 173.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.517 ' HB2' ' HB3' ' A' ' 1' ' ' ALA . 34.7 t -63.09 -38.37 90.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.179 175.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.606 ' HB2' ' HA ' ' A' ' 6' ' ' GLN . 58.6 m -65.0 -28.17 69.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.553 174.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.47 ' OE1' HG13 ' A' ' 35' ' ' ILE . 1.4 tp10 -66.91 -42.92 84.6 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 HG21 ' A' ' 24' ' ' ILE . 2.0 mp -52.26 -42.85 38.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 121.052 0.453 . . . . 0.0 110.515 169.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 36.3 mt-10 -63.82 -24.02 67.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.348 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -70.52 -50.49 37.24 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.158 -178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.796 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -72.48 -23.99 61.11 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.654 176.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.614 ' N ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -57.18 -34.29 68.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.072 175.262 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -67.06 -13.06 61.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.743 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.587 HE21 ' HA ' ' A' ' 14' ' ' LEU . 46.4 mt-30 -85.58 -12.22 52.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.649 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.2 -3.59 29.89 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.417 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' HD12 ' A' ' 42' ' ' LEU . 20.6 m-85 -58.13 157.99 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.479 0.657 . . . . 0.0 112.474 -174.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.491 ' HB2' ' HG2' ' A' ' 22' ' ' GLN . 1.3 p -95.84 135.19 37.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.667 -175.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.62 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 48.3 p90 -66.57 -26.91 67.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.118 -176.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 20' ' ' SER . 8.8 pt20 -63.13 -45.91 89.77 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.713 0.768 . . . . 0.0 109.954 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.529 ' HB3' HG11 ' A' ' 46' ' ' VAL . 20.9 m-20 -81.13 -29.13 34.86 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.485 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.637 HG13 HD11 ' A' ' 42' ' ' LEU . 39.8 mt -57.44 -48.53 82.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.177 173.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.666 ' HA ' HD12 ' A' ' 28' ' ' LEU . 54.3 tt0 -63.07 -39.94 96.21 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.711 ' O ' HG22 ' A' ' 29' ' ' VAL . 36.4 ttmt -53.88 -47.26 71.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.062 176.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -59.93 -41.79 92.57 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.328 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 25' ' ' GLN . 31.4 mt -64.95 -36.57 84.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.778 -177.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.0 m -67.1 -30.52 49.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.197 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.842 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.67 -32.92 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-O 121.218 0.533 . . . . 0.0 109.579 174.189 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.598 ' HA ' ' SD ' ' A' ' 37' ' ' MET . . . -82.95 4.3 26.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.765 -177.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.496 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 42.49 43.83 3.3 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.602 0.715 . . . . 0.0 110.768 -172.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 58.1 49.05 12.06 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 114.398 -1.273 . . . . 0.0 111.725 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.597 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 1.2 m-80 -83.59 163.74 20.18 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 173.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.687 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.8 tt -78.4 -64.22 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 121.606 0.717 . . . . 0.0 109.199 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.687 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.2 pt-20 -76.29 -36.89 58.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.264 -174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 31' ' ' ALA . 38.4 ttm -63.79 -29.66 70.84 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.723 0.297 . . . . 0.0 111.204 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.624 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -77.05 -52.83 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 35' ' ' ILE . 17.7 ptpt -60.08 -29.89 68.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.05 0.453 . . . . 0.0 110.637 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -75.16 -36.92 61.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.799 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.842 HG13 HD12 ' A' ' 30' ' ' ILE . 10.6 mm -66.48 -38.6 82.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.047 177.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.637 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.66 -49.07 78.9 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.185 174.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.64 -45.77 66.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.477 177.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.81 -41.21 71.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 111.995 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -93.84 -73.0 0.58 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.48 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.529 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -96.08 139.44 19.17 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.4 -168.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 m -114.44 159.37 20.39 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.518 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.549 ' HB ' ' H ' ' A' ' 50' ' ' SER . 0.0 OUTLIER -108.0 177.21 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.497 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -86.15 5.33 34.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.489 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.549 ' H ' ' HB ' ' A' ' 48' ' ' ILE . 49.3 m -74.19 132.78 78.9 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.363 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.416 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 45.1 Cg_endo -67.39 -168.9 0.19 Allowed 'Trans proline' 0 C--O 1.235 0.375 0 C-N-CA 123.306 2.671 . . . . 0.0 113.088 -176.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 51' ' ' PRO . . . 75.1 -56.54 0.62 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.516 0.726 . . . . 0.0 110.222 -174.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -98.4 81.25 2.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.8 -42.39 14.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.682 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -172.81 126.91 0.48 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.026 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.122 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.351 179.04 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 110.49 -0.189 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.5 m -73.62 -41.97 62.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.44 0.638 . . . . 0.0 109.519 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.86 139.72 53.69 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.244 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.632 ' HB2' ' HB2' ' A' ' 8' ' ' SER . 26.6 p -61.57 123.99 79.15 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 121.14 0.495 . . . . 0.0 110.783 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.572 ' HG2' ' OE1' ' A' ' 6' ' ' GLN . 26.9 Cg_endo -93.43 -111.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.079 2.52 . . . . 0.0 115.076 -174.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.572 ' OE1' ' HG2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -78.45 -36.9 44.81 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.108 -163.536 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.489 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.6 tm? -59.78 -43.21 94.49 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' HD12 ' A' ' 11' ' ' ILE . 47.7 t -65.71 -32.17 73.57 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.943 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 74.1 m -63.78 -32.35 73.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.542 176.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.1 mm-40 -64.38 -48.31 75.93 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.768 HG22 ' HG3' ' A' ' 15' ' ' MET . 69.9 mt -52.84 -51.15 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.46 171.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.708 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -57.53 -27.51 62.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.771 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.451 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 3.0 t-20 -60.81 -50.65 72.59 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.544 0.211 . . . . 0.0 110.745 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.967 ' HA ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -83.96 -24.42 30.66 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 119.166 -1.013 . . . . 0.0 110.946 179.263 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.768 ' HG3' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -60.11 -39.69 87.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.91 175.587 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -66.07 -17.4 64.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.044 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.967 HE21 ' HA ' ' A' ' 14' ' ' LEU . 40.7 mt-30 -80.43 -16.82 53.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.964 0.412 . . . . 0.0 110.951 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.72 -2.18 24.61 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.316 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.476 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.3 m-85 -59.08 166.96 1.85 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.17 0.509 . . . . 0.0 111.739 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -104.71 133.98 48.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.992 -172.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.598 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 31.5 p90 -65.16 -28.57 69.5 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.927 -170.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -62.23 -52.14 64.96 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.008 0.432 . . . . 0.0 110.878 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.609 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.4 m-20 -74.74 -25.01 58.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.352 177.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.691 HD13 ' HG2' ' A' ' 15' ' ' MET . 42.1 mt -60.66 -49.5 84.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.002 0.429 . . . . 0.0 110.05 173.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 29.6 tt0 -63.9 -37.31 86.91 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.381 176.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 37.4 ttmt -54.66 -50.61 67.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.035 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.555 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -56.64 -41.1 76.6 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.087 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.0 mt -63.95 -37.93 89.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -68.97 -30.41 46.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.06 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.739 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.61 -27.42 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.139 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.33 10.68 26.4 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.768 -176.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 43.15 46.91 5.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.275 0.56 . . . . 0.0 110.639 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 51.61 33.2 10.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.224 1.41 . . . . 0.0 113.277 -176.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 11.7 m-20 -70.99 149.69 46.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.339 174.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.56 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.2 tt -65.77 -59.69 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-O 121.605 0.716 . . . . 0.0 110.4 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.56 ' H ' HG23 ' A' ' 35' ' ' ILE . 12.3 pt-20 -75.53 -40.48 56.9 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.982 -172.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.591 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 43.0 tpp -67.71 -32.79 73.67 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.886 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.555 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.54 -51.92 37.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.893 0.377 . . . . 0.0 111.808 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.486 ' HB3' HD12 ' A' ' 14' ' ' LEU . 18.7 ptpt -62.65 -29.24 70.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.638 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -77.08 -39.9 48.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.739 HG13 HD12 ' A' ' 30' ' ' ILE . 11.9 mm -63.74 -38.79 83.23 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.402 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.688 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -60.29 -48.5 81.46 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.083 173.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -40.9 65.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.667 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -76.94 -31.99 57.02 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.028 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 11.4 m-85 -106.48 -80.56 0.56 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.609 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.18 135.27 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.164 -170.819 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.4 p -113.51 165.79 12.14 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.648 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -98.5 134.69 36.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.777 -174.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 t -86.64 -5.09 59.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.166 0.507 . . . . 0.0 110.031 177.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -72.04 140.97 83.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.593 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.49 99.48 0.83 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.82 2.347 . . . . 0.0 112.066 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -112.76 160.51 17.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.439 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -120.48 9.58 10.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.041 177.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.02 134.67 40.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.54 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -152.04 79.92 1.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.909 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.133 -0.937 . . . . 0.0 110.237 -176.728 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.149 0.5 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 19.1 m -85.63 66.08 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.511 0.672 . . . . 0.0 110.062 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.3 -78.87 0.52 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.242 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 19.4 m -118.85 126.06 27.34 Favored Pre-proline 0 N--CA 1.445 -0.677 0 CA-C-O 120.8 0.333 . . . . 0.0 111.115 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 12.9 Cg_exo -73.11 -8.63 22.41 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.123 2.549 . . . . 0.0 111.528 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.527 ' O ' ' HB3' ' A' ' 9' ' ' SER . 47.3 mt-30 -75.61 -39.68 57.56 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.219 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.43 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.4 tm? -67.99 -42.68 80.42 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.552 ' HA ' HD13 ' A' ' 11' ' ' ILE . 38.6 t -65.69 -24.67 67.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.193 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.527 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.1 t -70.0 -30.83 68.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.534 175.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 73.2 mm-40 -58.75 -46.87 86.47 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 175.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.701 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -53.09 -50.34 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.779 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 5.7 mm-40 -61.85 -24.68 67.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.665 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 9.6 t-20 -63.87 -50.9 67.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.839 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -80.22 -22.91 41.32 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.956 179.119 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.6 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 12.9 mmm -56.58 -38.0 71.38 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.632 171.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.9 t -64.79 -12.09 43.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.724 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -92.26 -14.98 28.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.606 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.77 -5.04 22.65 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.73 176.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.742 ' HB3' HD12 ' A' ' 42' ' ' LEU . 41.9 m-85 -59.57 163.77 3.98 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 111.686 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 24' ' ' ILE . 53.4 m -108.78 136.3 48.58 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -171.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.571 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.6 m-85 -57.56 -36.97 72.36 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.638 -174.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -54.93 -50.17 69.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.919 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.774 ' HB3' HG11 ' A' ' 46' ' ' VAL . 6.5 m-20 -81.82 -23.12 36.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.701 HG21 HG23 ' A' ' 11' ' ' ILE . 42.2 mt -58.19 -49.83 80.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.794 0.33 . . . . 0.0 110.188 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.702 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.8 tt0 -62.39 -38.17 88.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.342 0.592 . . . . 0.0 109.626 176.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.654 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 20.8 mtpp -58.64 -38.89 79.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.058 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.6 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -66.37 -38.96 88.76 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.523 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.702 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.7 mt -64.11 -37.24 86.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.521 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 26' ' ' LYS . 5.1 m -68.53 -30.89 48.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.344 -177.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.755 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.57 -29.12 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.718 0.771 . . . . 0.0 109.708 176.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.17 8.44 27.0 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.993 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.432 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.2 OUTLIER 40.43 52.0 2.9 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.531 0.681 . . . . 0.0 111.008 -172.607 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 47.01 44.71 15.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.982 1.313 . . . . 0.0 112.613 -174.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.505 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -79.38 154.87 28.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.05 175.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.709 HG23 ' H ' ' A' ' 36' ' ' GLU . 2.0 tt -65.56 -70.6 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.782 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.709 ' H ' HG23 ' A' ' 35' ' ' ILE . 47.6 mm-40 -75.35 -36.89 60.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.618 -173.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.582 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 14.4 tpt -63.02 -36.3 83.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.225 -174.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.36 -52.61 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.921 0.391 . . . . 0.0 111.825 178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.61 ' HB3' HD12 ' A' ' 14' ' ' LEU . 17.5 ptpt -62.93 -29.67 70.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.927 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.6 m-20 -78.32 -32.53 49.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.328 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.755 HG13 HD12 ' A' ' 30' ' ' ILE . 13.0 mm -67.4 -38.51 80.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.199 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -58.09 -54.14 50.31 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 172.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 46.8 ttt180 -44.9 -52.82 8.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.563 175.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.87 -44.71 84.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.774 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 20.7 m-85 -99.94 -80.68 0.47 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.774 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -85.61 125.91 40.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -172.505 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.2 p -100.28 174.35 6.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.64 -178.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.92 105.44 16.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.611 -177.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.0 m -97.58 4.4 50.27 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.924 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 m -119.22 126.82 26.82 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.757 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.59 -28.12 3.68 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.387 2.058 . . . . 0.0 110.532 168.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -152.47 92.56 1.69 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.511 -1.222 . . . . 0.0 108.425 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -70.92 123.12 21.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.338 -173.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.81 119.81 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.553 0.692 . . . . 0.0 111.282 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -115.74 97.79 6.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.08 177.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.0 p . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.542 179.659 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 120.957 0.408 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.5 p -85.24 -68.76 0.7 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.285 0.564 . . . . 0.0 110.593 177.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -159.62 156.09 27.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.954 178.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.2 t -75.52 125.21 88.94 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 121.012 0.435 . . . . 0.0 110.538 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -69.99 -19.92 34.4 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.973 2.449 . . . . 0.0 111.732 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' A' ' 9' ' ' SER . 78.3 mt-30 -83.71 -42.37 16.66 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.66 178.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.611 HD11 HD22 ' A' ' 33' ' ' ASN . 1.5 tm? -63.36 -49.27 74.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.08 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.733 ' HA ' HD12 ' A' ' 11' ' ' ILE . 30.6 t -56.67 -35.71 68.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 174.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.506 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 30.6 t -63.98 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.498 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' HB3' ' HA ' ' A' ' 35' ' ' ILE . 2.8 mm-40 -63.48 -48.05 79.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 176.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.733 HD12 ' HA ' ' A' ' 8' ' ' SER . 14.5 mt -59.96 -49.85 82.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.118 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.694 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.1 mt-10 -63.06 -25.19 68.26 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.675 -178.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -62.36 -51.29 68.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.456 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.786 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.19 -24.03 35.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.64 176.605 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.694 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 1.2 mmt -54.12 -29.0 43.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.785 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 t -75.5 -9.69 58.8 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.186 0.517 . . . . 0.0 110.438 -169.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.674 HE21 ' HA ' ' A' ' 14' ' ' LEU . 2.3 mp0 -80.88 -23.82 38.75 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.301 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.46 4.8 21.61 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.291 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -61.96 167.79 3.6 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.054 0.454 . . . . 0.0 111.186 -177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.8 m -104.14 130.71 51.88 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.336 -170.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 10.9 p90 -67.09 -23.64 65.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.519 -170.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.505 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -59.82 -53.9 52.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.083 0.468 . . . . 0.0 110.578 177.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.731 ' HB3' HG11 ' A' ' 46' ' ' VAL . 1.5 m-20 -82.93 -23.83 33.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.497 -179.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.641 HG13 HD11 ' A' ' 42' ' ' LEU . 24.3 mt -59.86 -50.2 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.644 0.259 . . . . 0.0 110.381 175.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.746 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.5 tt0 -65.11 -34.73 79.09 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.678 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.0 ttpp -61.34 -40.28 93.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.12 177.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.23 -39.59 95.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.687 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 25' ' ' GLN . 35.7 mt -64.93 -36.59 84.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.494 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.678 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.6 m -69.33 -30.04 44.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.413 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.79 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.37 -31.24 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.39 11.56 16.54 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.53 -177.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? 36.05 43.97 0.23 Allowed 'General case' 0 N--CA 1.474 0.764 0 O-C-N 124.019 0.825 . . . . 0.0 112.316 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.611 HD22 HD11 ' A' ' 7' ' ' LEU . 16.0 m120 68.76 29.73 5.09 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.035 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 37' ' ' MET . 14.5 m-20 -72.62 151.13 42.48 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 120.999 0.428 . . . . 0.0 110.603 171.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.821 HG23 ' HG3' ' A' ' 36' ' ' GLU . 11.8 tt -72.79 -53.1 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.363 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.821 ' HG3' HG23 ' A' ' 35' ' ' ILE . 19.2 mt-10 -75.62 -45.26 38.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.98 -175.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 17.4 tpt -63.59 -30.16 71.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 -175.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -75.09 -51.98 12.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.875 176.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HE3' HG12 ' A' ' 35' ' ' ILE . 19.3 ptpt -60.9 -31.16 70.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.002 0.43 . . . . 0.0 110.51 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 -69.4 -41.77 75.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.448 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.79 HG13 HD12 ' A' ' 30' ' ' ILE . 14.1 mm -65.83 -38.61 82.6 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.232 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.641 HD11 HG13 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.3 -50.38 73.86 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 172.535 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -53.76 -36.66 62.61 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.283 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -81.36 -31.09 33.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.015 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 16.7 m-85 -110.31 -79.8 0.58 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.2 -171.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.731 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -97.18 127.27 49.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.049 -173.304 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -125.55 153.52 43.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.709 -175.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -82.51 141.87 14.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.023 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.3 t -94.72 18.91 10.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.426 0.631 . . . . 0.0 109.568 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.503 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 24.6 t -118.9 129.41 25.41 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.362 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 12.6 Cg_exo -71.37 -12.0 29.18 Favored 'Trans proline' 0 C--O 1.234 0.307 0 C-N-CA 122.779 2.319 . . . . 0.0 112.586 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 69.15 -56.59 0.54 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.665 0.786 . . . . 0.0 112.055 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -74.44 -48.44 27.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.084 0.468 . . . . 0.0 109.947 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 62.4 t -73.48 111.69 8.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.689 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -108.86 -12.16 14.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.471 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.258 178.485 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.5 m 58.44 46.39 15.21 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.287 0.565 . . . . 0.0 110.476 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -162.03 88.68 0.69 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.62 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.5 t -88.0 127.2 58.5 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.983 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.19 -23.41 33.4 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.771 2.314 . . . . 0.0 111.149 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 9' ' ' SER . 93.8 mt-30 -78.72 -37.33 41.75 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.834 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.0 tm? -63.68 -45.8 88.42 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.494 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.4 t -60.11 -35.03 74.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.018 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.2 m -60.98 -29.57 69.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.464 177.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.595 ' HB3' ' HB ' ' A' ' 35' ' ' ILE . 3.5 mm-40 -63.24 -49.47 73.99 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.442 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.7 mp -58.51 -49.3 82.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.42 174.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.637 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 50.4 mt-10 -63.51 -24.49 67.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.995 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -61.9 -50.09 73.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.504 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.824 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.15 -23.27 38.39 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.275 178.104 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.637 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 22.4 mmm -57.28 -26.39 60.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.787 177.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.6 p -61.41 -22.78 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.956 0.408 . . . . 0.0 111.104 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -79.62 -20.41 46.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.071 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.83 6.16 26.73 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.511 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -60.4 172.88 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.5 m -112.4 134.47 53.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.468 -170.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.448 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 70.3 m-85 -58.54 -35.37 72.21 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.725 -173.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.486 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 2.7 pt20 -56.35 -54.33 46.77 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.557 0.536 . . . . 0.0 111.724 -176.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.667 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 5.9 m-20 -80.74 -23.56 39.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.724 HG13 HD11 ' A' ' 42' ' ' LEU . 23.8 mt -59.12 -50.08 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.919 0.39 . . . . 0.0 110.084 173.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.727 ' HA ' HD12 ' A' ' 28' ' ' LEU . 52.9 tt0 -60.8 -40.77 93.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.533 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 16.1 mtpp -57.66 -43.69 85.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.069 175.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -63.37 -42.06 98.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.359 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 25' ' ' GLN . 39.2 mt -61.83 -37.28 83.87 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.931 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.5 m -69.03 -30.98 48.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.293 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.804 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.88 -30.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.437 0.637 . . . . 0.0 109.349 175.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.621 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -88.3 12.99 12.55 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.422 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 40.35 52.17 2.86 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.875 0.734 . . . . 0.0 110.88 -176.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 48.52 51.35 15.52 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.449 -1.25 . . . . 0.0 112.856 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.475 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 7.9 m-20 -93.48 158.77 15.55 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.36 174.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.625 HG23 ' HG3' ' A' ' 36' ' ' GLU . 6.2 tt -77.44 -60.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.003 176.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.671 ' HA ' ' HG2' ' A' ' 39' ' ' LYS . 3.5 mt-10 -73.49 -43.82 59.26 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.617 -174.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.621 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 16.0 tpt -62.95 -33.98 76.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.35 -175.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.589 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -72.1 -51.95 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.791 176.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.671 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 10.4 ptpt -60.56 -31.22 70.34 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.095 0.474 . . . . 0.0 110.76 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.414 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 75.2 m-20 -78.56 -35.08 46.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.577 -178.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.804 HG13 HD12 ' A' ' 30' ' ' ILE . 11.4 mm -67.12 -38.78 81.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.595 174.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.724 HD11 HG13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -58.49 -49.07 78.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.161 172.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.01 -33.82 62.94 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.197 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 34.7 mm-40 -83.02 -25.87 31.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.957 0.408 . . . . 0.0 112.007 178.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -110.9 -75.17 0.62 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.466 0.65 . . . . 0.0 112.17 -171.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.44 HG11 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -96.84 146.23 7.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.036 -168.26 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.5 p -118.06 171.33 8.16 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.767 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -100.78 144.41 12.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.252 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 45.6 m -92.17 2.63 56.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.582 0.706 . . . . 0.0 109.098 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 17.0 m -110.01 127.66 26.7 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.408 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 21.1 Cg_exo -68.48 -47.69 1.39 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.951 2.434 . . . . 0.0 111.921 177.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 46.21 41.73 9.15 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 123.604 0.565 . . . . 0.0 111.539 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -97.23 -47.52 5.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.976 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 29.7 m -105.69 23.42 2.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.317 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.14 11.61 18.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.018 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.143 -0.932 . . . . 0.0 109.361 -179.756 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.75 0.31 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.4 t -103.65 47.14 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.847 0.832 . . . . 0.0 110.276 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.84 167.18 26.33 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.147 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.413 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 21.4 m -78.03 125.67 84.95 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 121.023 0.439 . . . . 0.0 110.145 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 23.8 Cg_exo -65.81 -27.47 51.74 Favored 'Trans proline' 0 C--O 1.221 -0.37 0 C-N-CA 123.336 2.691 . . . . 0.0 112.47 -176.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 9' ' ' SER . 4.2 pt20 -70.47 -33.68 71.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.369 0.604 . . . . 0.0 110.593 -178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.497 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.7 tm? -72.13 -41.81 66.74 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' ' HG2' ' A' ' 12' ' ' GLU . 43.1 t -62.52 -30.75 71.51 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.16 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 54.9 m -60.85 -31.11 70.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.151 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.9 ' HB3' HD13 ' A' ' 35' ' ' ILE . 18.9 mm-40 -60.69 -49.89 75.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.077 0.465 . . . . 0.0 109.794 172.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.507 HG23 HG21 ' A' ' 24' ' ' ILE . 2.8 mp -54.15 -46.08 66.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.611 173.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 8.5 mm-40 -59.26 -25.31 63.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.601 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 7.0 t-20 -64.04 -51.76 62.62 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.878 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -78.85 -23.49 44.94 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.325 -0.95 . . . . 0.0 110.136 179.159 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.644 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -60.19 -39.47 86.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.352 173.662 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.6 t -69.74 -11.92 61.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.154 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -86.32 -22.5 26.71 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.256 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 122.87 -9.3 9.11 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.877 -0.677 . . . . 0.0 113.054 176.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.861 ' HB3' HD12 ' A' ' 42' ' ' LEU . 50.2 m-85 -61.03 162.49 7.05 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.933 0.397 . . . . 0.0 111.933 -175.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -100.82 133.23 45.6 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.417 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 0.3 OUTLIER -54.86 -35.96 64.58 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.92 -172.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -62.87 -51.72 65.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 -175.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.75 ' HB3' HG11 ' A' ' 46' ' ' VAL . 12.7 m-20 -79.08 -23.52 44.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.76 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.575 HD13 ' HG2' ' A' ' 15' ' ' MET . 34.9 mt -58.69 -50.08 80.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 172.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.74 ' HA ' HD12 ' A' ' 28' ' ' LEU . 18.8 tm0? -62.98 -39.66 95.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 43.4 mtpt -57.84 -45.28 86.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.39 175.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.552 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -59.84 -37.59 79.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.83 0.348 . . . . 0.0 110.816 178.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 25' ' ' GLN . 42.2 mt -64.23 -38.59 91.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.872 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -68.79 -30.96 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.77 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.51 -28.43 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.03 12.22 20.48 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.596 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 43.33 47.68 5.75 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.447 0.641 . . . . 0.0 110.665 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.63 35.97 12.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.265 1.426 . . . . 0.0 113.34 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.42 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.0 m-20 -77.04 142.23 39.96 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.585 169.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.9 HD13 ' HB3' ' A' ' 10' ' ' GLU . 2.4 tp -68.01 -54.99 18.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-O 121.253 0.549 . . . . 0.0 110.76 174.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.473 ' H ' HG23 ' A' ' 35' ' ' ILE . 25.7 mt-10 -65.75 -48.44 71.87 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.677 -174.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.629 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 53.4 tpp -64.97 -32.31 73.98 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.712 -176.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.552 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.5 -51.88 25.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 36' ' ' GLU . 16.5 ptpt -62.14 -29.05 70.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.107 0.48 . . . . 0.0 110.149 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.2 -39.56 60.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.014 179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.77 HG13 HD12 ' A' ' 30' ' ' ILE . 10.5 mm -63.88 -38.87 83.48 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.356 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.861 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 172.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -54.71 -34.79 62.88 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.482 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -86.21 -27.6 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.878 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 8.0 m-85 -114.76 -79.37 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.187 0.518 . . . . 0.0 111.956 -174.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -98.02 117.69 43.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.855 -175.154 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.562 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 1.7 p -114.99 -178.37 3.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.502 0.668 . . . . 0.0 111.576 -174.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.04 153.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.225 -173.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.9 t -90.39 51.54 2.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.462 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 25.8 p -74.73 151.15 86.77 Favored Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.047 -175.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 11.9 Cg_exo -71.72 14.99 0.38 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.432 2.755 . . . . 0.0 112.853 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.02 68.18 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.283 0.563 . . . . 0.0 110.547 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 10.7 p80 -158.45 158.51 34.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.471 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.8 m -83.25 77.98 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.555 0.693 . . . . 0.0 111.442 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.444 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . . . -80.63 -68.4 0.69 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.436 177.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 19.8 p . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.589 175.244 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.8 t -134.51 134.3 41.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.332 0.587 . . . . 0.0 111.146 178.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.64 26.73 1.02 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.436 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m -76.05 129.86 79.6 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.57 -178.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.52 ' HB2' ' H ' ' A' ' 6' ' ' GLN . 64.3 Cg_endo -79.06 -136.54 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.943 2.429 . . . . 0.0 112.704 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.585 ' O ' ' HB2' ' A' ' 9' ' ' SER . 52.4 mt-30 -90.24 -47.17 7.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.421 -170.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 1.6 tm? -61.74 -42.1 98.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.11 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.7 t -66.93 -24.33 66.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.27 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.585 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 11.7 m -71.07 -31.78 68.28 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.767 176.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.93 -47.19 86.79 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.699 HD11 HD11 ' A' ' 28' ' ' LEU . 87.8 mt -56.19 -53.67 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.755 174.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.574 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 11.5 mm-40 -57.21 -25.84 59.73 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.958 -176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -66.34 -51.09 60.78 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.867 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.751 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.64 -22.65 43.31 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.811 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 16.6 mmm -53.73 -38.87 64.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.748 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.9 m -71.63 -3.07 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.003 -177.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -87.98 -16.76 32.86 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 -2.68 24.16 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.76 176.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.628 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.0 m-85 -61.36 168.57 2.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.191 0.52 . . . . 0.0 111.974 -176.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -113.67 136.08 53.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.119 -169.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.628 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.0 m-85 -59.55 -34.92 73.27 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.139 -174.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -53.61 -50.59 65.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.018 0.437 . . . . 0.0 111.191 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.544 ' HB3' HG11 ' A' ' 46' ' ' VAL . 23.1 m-20 -82.49 -26.86 32.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.784 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.628 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 41.3 mt -60.17 -49.98 82.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.201 0.524 . . . . 0.0 110.398 174.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.735 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.91 -35.49 80.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.961 178.192 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.681 ' O ' HG22 ' A' ' 29' ' ' VAL . 1.5 ttmm -59.04 -45.98 89.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.829 176.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.497 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.39 -40.6 82.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.95 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 25' ' ' GLN . 37.4 mt -62.19 -40.1 94.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.688 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.681 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.6 m -67.63 -31.53 52.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.264 -175.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.653 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -27.66 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-O 121.726 0.774 . . . . 0.0 109.265 177.035 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.649 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -91.94 13.62 18.07 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.434 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 42.15 43.78 2.95 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.643 0.589 . . . . 0.0 111.527 -175.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 55.25 57.05 5.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.841 -1.072 . . . . 0.0 110.795 -175.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 3.7 t-20 -90.26 154.13 19.96 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.494 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.699 HG23 ' H ' ' A' ' 36' ' ' GLU . 1.6 tt -67.3 -64.92 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.913 169.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 35' ' ' ILE . 26.8 mt-10 -71.64 -49.78 36.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.309 -175.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.649 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 3.2 tpt -62.22 -34.58 76.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.342 -168.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -69.68 -52.73 23.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.799 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.603 ' HB3' HD12 ' A' ' 14' ' ' LEU . 1.4 ptpm? -66.01 -29.03 69.33 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.773 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 89.4 m-20 -76.14 -32.64 59.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.205 -179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.653 HG13 HD12 ' A' ' 30' ' ' ILE . 10.8 mm -68.01 -38.41 79.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.186 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.683 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -57.04 -51.39 69.48 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 172.14 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 21.9 ttp180 -48.45 -48.96 37.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.89 175.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 43.8 mt-10 -77.78 -24.34 48.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.862 -175.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 10.2 m-85 -116.16 -75.92 0.58 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -171.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.683 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -86.37 138.3 19.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.383 -170.567 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -105.58 174.57 5.82 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.433 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -95.55 126.18 48.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 120.895 0.378 . . . . 0.0 111.772 -172.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -72.15 -18.12 61.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -74.8 139.52 73.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.692 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.63 48.47 1.61 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.88 2.387 . . . . 0.0 112.283 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.21 111.35 9.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.698 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -84.13 155.15 22.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.237 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.5 m -94.67 28.95 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.216 0.531 . . . . 0.0 111.317 -174.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.3 87.38 2.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.305 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.341 -178.03 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.003 0 CA-C-O 120.486 0.184 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.8 m 64.77 54.75 1.32 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.75 0.786 . . . . 0.0 110.026 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -135.98 158.41 44.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.849 178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.6 m -59.05 138.71 87.79 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.235 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.485 ' O ' ' HB3' ' A' ' 8' ' ' SER . 17.5 Cg_endo -57.73 -8.82 4.71 Favored 'Trans proline' 0 N--CA 1.476 0.454 0 C-N-CA 123.579 2.853 . . . . 0.0 113.488 -178.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.574 ' O ' ' HB2' ' A' ' 9' ' ' SER . 22.9 mt-30 -71.68 -24.24 61.79 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.576 0.703 . . . . 0.0 110.361 174.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.3 tm? -69.66 -39.06 77.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 170.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.586 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 45.6 t -63.75 -26.68 68.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.807 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.574 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 73.4 m -69.39 -30.79 68.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.999 173.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.603 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 4.2 mm-40 -63.0 -34.61 77.92 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.643 HG23 HG21 ' A' ' 24' ' ' ILE . 51.2 mt -55.03 -48.62 75.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.895 171.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.717 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 44.3 mt-10 -58.16 -25.85 62.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.012 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -64.55 -48.05 76.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.176 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.879 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.06 -24.28 32.8 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.669 175.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.717 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 23.9 mmm -55.15 -45.6 75.68 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.913 176.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.4 p -68.81 -3.53 12.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.996 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -88.22 -12.88 42.49 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.192 174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.69 -8.06 22.02 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.192 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.652 ' HB3' HD12 ' A' ' 42' ' ' LEU . 37.3 m-85 -61.75 157.22 18.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.124 0.488 . . . . 0.0 111.183 -176.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.2 m -100.87 129.51 46.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.338 0.59 . . . . 0.0 111.619 -171.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.713 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.2 p90 -60.71 -26.4 67.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.231 -174.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -59.14 -51.62 69.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.074 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.665 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -82.28 -22.61 35.66 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.024 177.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.713 ' HB ' ' HA ' ' A' ' 21' ' ' TYR . 39.6 mt -57.76 -50.24 78.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.83 0.348 . . . . 0.0 110.674 174.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.5 tt0 -61.85 -38.35 87.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.607 0.717 . . . . 0.0 109.529 176.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.679 ' O ' HG22 ' A' ' 29' ' ' VAL . 34.4 mtpt -61.4 -40.11 93.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.214 176.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.533 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -65.27 -38.06 89.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.89 176.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.757 HD12 ' HA ' ' A' ' 25' ' ' GLN . 38.9 mt -63.56 -36.27 83.23 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.651 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.4 m -70.04 -30.76 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.102 -177.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.734 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.32 -26.62 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.401 0.619 . . . . 0.0 109.486 175.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.27 10.79 28.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.632 HE21 ' ND2' ' A' ' 34' ' ' ASN . 1.5 pm0 43.54 47.18 6.16 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.248 0.546 . . . . 0.0 110.676 -174.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 47.4 43.23 15.23 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.788 1.235 . . . . 0.0 112.89 -174.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.632 ' ND2' HE21 ' A' ' 32' ' ' GLN . 81.2 m-20 -81.68 136.69 35.49 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.61 170.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.676 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.7 tt -61.31 -48.03 90.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.805 176.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.676 ' HG3' HG23 ' A' ' 35' ' ' ILE . 27.0 mt-10 -72.86 -49.72 28.34 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.134 -174.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 59.6 tpp -67.43 -34.21 76.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.227 -172.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.533 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -64.79 -51.95 59.48 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 178.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -62.51 -29.9 70.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.98 0.419 . . . . 0.0 110.502 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -77.58 -37.12 51.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.824 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.734 HG13 HD12 ' A' ' 30' ' ' ILE . 15.4 mm -65.54 -37.82 80.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.544 177.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.801 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -55.43 -57.72 10.71 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.12 -41.16 16.9 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.292 176.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.02 -38.87 31.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 17.9 m-85 -101.23 -71.58 0.71 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.334 0.588 . . . . 0.0 112.229 -171.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.801 HG13 ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -92.09 134.82 29.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.213 -170.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.8 m -104.68 164.25 11.9 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.971 -175.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -159.6 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.641 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.1 t 61.63 38.42 15.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -170.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.534 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 25.1 m -60.9 130.67 91.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.737 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.534 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 2.5 Cg_endo -80.65 174.87 10.65 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.26 2.64 . . . . 0.0 112.771 -174.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 65.75 -86.53 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.351 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.532 ' CE1' ' HB2' ' A' ' 55' ' ' ALA . 41.1 t-80 -145.6 131.91 19.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.747 -171.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.0 t -124.03 -43.8 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.783 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.532 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . . . 57.87 69.96 0.69 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 0.0 112.262 178.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 C--O 1.252 1.198 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.892 176.368 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 120.844 0.354 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 21.8 m -83.29 -41.98 17.68 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.777 -177.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.85 68.24 5.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.153 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 p -64.79 126.97 92.08 Favored Pre-proline 0 N--CA 1.447 -0.623 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.543 -176.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.36 -27.53 47.45 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.154 2.569 . . . . 0.0 112.55 -178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' SER . 23.9 mt-30 -72.09 -44.09 63.78 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.272 0.558 . . . . 0.0 110.015 -177.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.501 HD11 ' ND2' ' A' ' 33' ' ' ASN . 4.7 tt -60.8 -47.99 83.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.946 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 39.9 t -57.95 -35.26 70.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.492 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.6 m -66.36 -31.96 73.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.507 177.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 6' ' ' GLN . 2.1 mm-40 -62.08 -45.55 93.03 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.583 HG23 HG21 ' A' ' 24' ' ' ILE . 3.4 mp -58.75 -48.99 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.65 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.614 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 46.6 mt-10 -61.15 -26.54 67.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -62.95 -50.37 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.818 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.819 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.02 -23.03 36.16 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.055 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.614 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 10.1 mmm -56.24 -45.73 79.86 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.036 175.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.8 p -72.45 -2.51 19.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.071 -177.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -85.12 -19.06 32.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.29 -3.52 18.41 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.654 177.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 42' ' ' LEU . 45.2 m-85 -64.13 168.76 5.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.008 0.432 . . . . 0.0 111.383 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.9 m -105.95 131.03 53.74 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.262 0.553 . . . . 0.0 111.935 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 47.2 p90 -61.46 -30.58 70.69 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.945 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 23' ' ' ASP . 22.5 pt20 -56.89 -52.96 63.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.962 0.411 . . . . 0.0 110.981 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.714 ' HB3' HG11 ' A' ' 46' ' ' VAL . 9.2 m-20 -80.87 -23.15 39.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.583 HG21 HG23 ' A' ' 11' ' ' ILE . 54.0 mt -59.26 -50.21 80.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.724 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -66.02 -34.54 78.32 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.787 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 23' ' ' ASP . 40.9 mtpt -59.86 -46.35 89.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.985 174.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.74 -38.21 77.91 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.196 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 25' ' ' GLN . 44.3 mt -63.57 -37.52 87.63 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.3 m -69.65 -30.37 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.14 -177.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.796 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.54 -28.08 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-O 121.448 0.642 . . . . 0.0 109.335 176.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.626 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.88 11.99 25.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.565 -176.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 41.85 47.89 3.72 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.456 0.646 . . . . 0.0 110.458 -174.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.501 ' ND2' HD11 ' A' ' 7' ' ' LEU . 2.4 p-10 48.32 40.24 14.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.923 1.289 . . . . 0.0 113.165 -175.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 8.0 m-20 -74.65 148.87 40.27 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.393 171.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.577 HG23 ' H ' ' A' ' 36' ' ' GLU . 3.5 tt -65.33 -59.66 3.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.25 0.548 . . . . 0.0 110.979 173.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.577 ' H ' HG23 ' A' ' 35' ' ' ILE . 44.7 mt-10 -71.3 -45.96 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.015 -173.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.626 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.6 tpt -64.92 -33.22 75.5 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.912 -172.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.502 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -68.76 -52.42 30.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.725 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HZ3' HD12 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -63.81 -29.98 71.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.095 0.474 . . . . 0.0 110.635 179.002 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -75.56 -35.15 60.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.622 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.796 HG13 HD12 ' A' ' 30' ' ' ILE . 12.6 mm -65.48 -38.32 82.18 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.449 175.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.617 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -59.32 -54.51 45.93 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 171.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 tmm_? -52.93 -40.32 63.52 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.91 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.97 -44.31 61.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 111.966 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 29.2 m-85 -100.38 -80.55 0.48 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.67 -172.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.714 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -91.82 122.03 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.111 -172.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.409 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.8 m -112.45 168.5 9.59 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.553 -176.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -87.11 125.33 40.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.096 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.8 m -101.77 13.72 34.05 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.562 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 51' ' ' PRO . 55.6 p -105.59 170.23 6.13 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.215 -178.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 50' ' ' SER . 4.9 Cg_endo -49.0 -52.2 9.17 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.691 2.261 . . . . 0.0 111.801 174.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.63 -156.11 0.27 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.837 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 76.6 m80 69.23 26.1 5.51 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.472 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.5 t -90.24 63.27 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.706 0.765 . . . . 0.0 109.262 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -105.86 56.69 0.67 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.904 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.0 m . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.391 -178.62 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 120.713 0.292 . . . . 0.0 110.613 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 p -79.54 51.78 1.3 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.043 -177.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.63 23.37 9.28 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.817 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.422 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 15.2 m -69.57 127.37 92.74 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.135 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 26.1 Cg_exo -64.28 -20.12 66.42 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.047 2.498 . . . . 0.0 111.646 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.711 ' HA ' HE21 ' A' ' 6' ' ' GLN . 0.0 OUTLIER -69.92 -35.44 74.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.201 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.462 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.0 tm? -68.46 -42.64 78.46 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 176.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.1 t -62.49 -29.66 70.7 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.093 175.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.494 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.2 m -67.59 -30.95 70.68 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.531 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.17 -46.13 90.32 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.506 HG23 HG21 ' A' ' 24' ' ' ILE . 3.0 mp -54.17 -51.55 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.506 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 63.6 mm-40 -58.84 -26.25 63.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.651 -178.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -62.78 -50.85 69.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.414 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.836 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -81.87 -23.84 36.1 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.25 177.629 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.704 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -56.21 -32.48 64.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.941 176.542 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 t -59.35 -22.59 61.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.824 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' A' ' 14' ' ' LEU . 49.5 mt-30 -78.99 -21.53 46.9 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.245 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.79 1.65 22.69 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.744 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.429 ' CG ' HD12 ' A' ' 42' ' ' LEU . 30.9 m-85 -57.62 167.4 1.08 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.261 0.553 . . . . 0.0 112.305 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 p -99.25 135.22 40.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.333 -173.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 7.5 m-85 -62.7 -31.83 72.81 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.17 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -62.17 -48.43 80.12 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.609 0.719 . . . . 0.0 110.504 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.8 ' HB3' HG11 ' A' ' 46' ' ' VAL . 40.4 m-20 -82.75 -29.01 30.02 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.456 -177.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.565 HG13 HD11 ' A' ' 42' ' ' LEU . 23.1 mt -57.14 -49.11 80.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.026 172.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.709 ' HA ' HD12 ' A' ' 28' ' ' LEU . 28.3 tt0 -62.49 -39.83 94.73 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.914 176.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.662 ' O ' HG22 ' A' ' 29' ' ' VAL . 3.2 ttmm -55.63 -42.94 75.66 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.958 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.568 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -63.99 -41.6 97.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.957 178.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 25' ' ' GLN . 28.6 mt -63.62 -40.23 96.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.463 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 26' ' ' LYS . 3.8 m -64.86 -31.21 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.211 -176.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.764 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.97 -32.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.334 0.588 . . . . 0.0 109.58 175.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.601 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -85.47 8.68 18.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.234 -177.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.466 HE21 ' C ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 44.65 40.49 4.14 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.755 0.659 . . . . 0.0 110.999 -175.321 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 61.82 55.32 2.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.38 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.48 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 9.9 m-20 -103.05 145.0 30.55 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.685 175.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' H ' ' A' ' 36' ' ' GLU . 4.3 tt -62.6 -57.8 10.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.836 0.35 . . . . 0.0 111.384 176.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.535 ' H ' HG23 ' A' ' 35' ' ' ILE . 43.8 mt-10 -68.58 -50.87 48.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.516 -176.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.601 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 15.7 tpt -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.243 -170.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.568 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -71.53 -52.19 19.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.771 0.319 . . . . 0.0 111.822 177.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 35' ' ' ILE . 1.2 ptpm? -63.89 -28.99 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.907 0.384 . . . . 0.0 110.287 179.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.553 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 97.5 m-20 -76.36 -31.01 57.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.903 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.764 HG13 HD12 ' A' ' 30' ' ' ILE . 13.6 mm -70.57 -38.32 73.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.875 174.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.565 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -60.39 -48.51 81.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 170.88 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 8.7 tpm_? -46.02 -48.91 16.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.287 175.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 40' ' ' ASN . 33.7 mm-40 -74.72 -43.95 52.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.517 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 23.0 m-85 -97.88 -74.92 0.56 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.592 0.711 . . . . 0.0 112.516 -170.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.8 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -100.44 126.21 54.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.93 -169.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 p -99.21 178.19 4.98 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.36 -0.837 . . . . 0.0 109.207 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -85.05 80.33 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-O 121.913 0.864 . . . . 0.0 109.948 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.7 p -87.7 45.71 1.3 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 114.255 -1.339 . . . . 0.0 112.097 -173.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.511 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 47.0 t -107.12 125.21 33.06 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.511 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 49.6 Cg_endo -99.42 -1.09 0.87 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.313 2.675 . . . . 0.0 113.008 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 59.75 -167.21 0.17 Allowed 'General case' 0 CA--C 1.533 0.302 0 O-C-N 123.421 0.45 . . . . 0.0 110.014 -174.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -161.29 49.3 0.22 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.23 0.538 . . . . 0.0 110.526 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.42 13.57 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 61.67 20.64 11.5 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.696 -178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.876 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.73 0.3 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.4 m -81.46 130.89 35.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.009 -175.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.81 174.73 0.2 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.437 178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.433 ' HB3' ' HB2' ' A' ' 7' ' ' LEU . 48.0 t -114.29 125.41 29.31 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.378 177.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -67.04 -24.88 44.65 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.831 2.354 . . . . 0.0 111.301 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' HA ' ' OE1' ' A' ' 6' ' ' GLN . 6.3 mm-40 -80.82 -35.58 32.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.779 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.463 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.0 tm? -67.76 -42.92 80.97 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.678 173.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 22.7 t -59.79 -33.76 72.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.853 175.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 11.5 m -64.24 -30.71 71.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.143 176.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.3 mm-40 -60.66 -45.96 92.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.6 HG23 HG21 ' A' ' 24' ' ' ILE . 3.2 mp -56.08 -46.29 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.284 173.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 38.8 mt-10 -59.17 -26.5 64.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.093 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 8.5 t-20 -63.38 -51.39 66.06 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.867 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.91 -23.42 41.81 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 119.196 -1.001 . . . . 0.0 110.165 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.61 ' N ' HD22 ' A' ' 14' ' ' LEU . 12.2 mmm -57.94 -35.93 71.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.385 177.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.8 t -73.74 1.23 10.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.657 -177.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -94.24 -18.13 21.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.719 0.295 . . . . 0.0 110.404 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.75 0.35 24.46 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.574 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -63.61 166.99 6.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.237 0.542 . . . . 0.0 112.192 -176.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -102.01 130.32 48.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.369 -172.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 41.1 p90 -62.85 -30.4 71.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.611 -171.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.556 ' HG3' ' H ' ' A' ' 23' ' ' ASP . 1.5 pt20 -64.32 -49.7 70.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.192 0.52 . . . . 0.0 110.629 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.702 ' HB3' HG11 ' A' ' 46' ' ' VAL . 21.4 m-20 -73.16 -31.1 64.04 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.766 177.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.669 HG13 HD11 ' A' ' 42' ' ' LEU . 39.4 mt -56.53 -48.13 80.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.191 0.519 . . . . 0.0 110.199 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.72 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -64.35 -38.0 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.251 178.287 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.659 ' O ' HG22 ' A' ' 29' ' ' VAL . 8.1 ttmt -60.59 -42.83 97.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.322 176.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.591 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -61.72 -36.34 80.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.02 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.72 HD12 ' HA ' ' A' ' 25' ' ' GLN . 41.8 mt -65.77 -39.41 90.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.776 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.1 m -67.16 -30.68 50.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.222 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.852 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -85.87 -27.24 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 37' ' ' MET . . . -92.94 10.69 30.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.416 -176.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER 45.88 39.24 5.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.526 0.679 . . . . 0.0 111.109 -174.55 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 m120 62.18 48.26 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.96 -177.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.461 ' HB2' ' HB1' ' A' ' 31' ' ' ALA . 77.2 m-20 -94.13 150.68 20.11 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.634 173.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.769 HG23 ' HG3' ' A' ' 36' ' ' GLU . 4.6 tt -70.6 -53.63 21.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.341 0.591 . . . . 0.0 110.835 175.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.769 ' HG3' HG23 ' A' ' 35' ' ' ILE . 25.4 mt-10 -71.65 -46.02 60.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.417 -172.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.654 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 49.5 tpp -68.25 -31.04 70.23 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.818 0.342 . . . . 0.0 110.861 -174.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.591 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.73 -51.62 26.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.724 177.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 ptpt -61.06 -29.61 69.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.943 0.401 . . . . 0.0 110.517 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 14.3 m-80 -77.4 -34.63 54.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.801 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.852 HG13 HD12 ' A' ' 30' ' ' ILE . 13.2 mm -67.62 -37.65 79.08 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.711 176.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.669 HD11 HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -58.53 -50.37 74.02 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -53.77 -28.95 37.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.394 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 30.2 mt-10 -89.28 -41.3 12.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.261 0.553 . . . . 0.0 111.731 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -95.34 -74.6 0.55 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.82 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.702 HG11 ' HB3' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -102.3 126.72 56.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.562 0.696 . . . . 0.0 112.745 -169.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.6 p -104.57 169.95 8.17 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.3 84.25 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.748 . . . . 0.0 109.855 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.7 t -108.68 34.2 3.8 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.308 -177.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.444 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 6.0 p -82.59 142.39 46.02 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.36 175.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 11.8 Cg_exo -71.2 59.17 2.35 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.1 2.533 . . . . 0.0 112.821 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.7 -17.93 39.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.246 178.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 12.9 p80 35.75 74.86 0.07 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.185 0.994 . . . . 0.0 112.419 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.1 m -82.78 128.22 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.089 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -112.35 115.94 29.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.833 -177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.247 0.948 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.764 178.781 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.539 HG22 ' HG ' ' A' ' 7' ' ' LEU . 7.6 t -145.38 -9.77 0.56 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.734 0.302 . . . . 0.0 111.164 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.01 13.89 8.04 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.463 ' H ' HG23 ' A' ' 2' ' ' THR . 85.2 p -85.53 139.91 35.9 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-O 121.349 0.595 . . . . 0.0 110.172 176.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 4' ' ' SER . 32.2 Cg_exo -59.46 -27.13 84.19 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 123.435 2.756 . . . . 0.0 112.742 -177.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 9' ' ' SER . 15.7 mm100 -74.86 -37.97 62.08 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.907 0.384 . . . . 0.0 110.681 179.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.539 ' HG ' HG22 ' A' ' 2' ' ' THR . 2.1 tm? -61.84 -47.05 86.79 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 173.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.49 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 42.7 t -57.58 -35.98 71.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.045 174.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' A' ' 6' ' ' GLN . 58.3 m -63.4 -31.01 72.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.617 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 13' ' ' ASN . 3.4 mm-40 -61.18 -48.8 79.87 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.509 HG23 HG21 ' A' ' 24' ' ' ILE . 3.5 mp -55.53 -48.66 77.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.475 173.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.68 ' HA ' ' HB2' ' A' ' 15' ' ' MET . 42.2 mt-10 -60.68 -25.87 66.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.25 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.586 ' HB3' ' O ' ' A' ' 10' ' ' GLU . 5.5 t-20 -61.13 -51.53 68.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.654 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.861 ' H ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -82.85 -23.62 33.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.449 -0.9 . . . . 0.0 110.597 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . 8.8 mmm -57.06 -45.95 82.85 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.569 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -66.44 -13.12 60.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.901 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -80.35 -15.88 55.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.818 0.342 . . . . 0.0 110.106 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.81 -2.89 24.46 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.604 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.655 ' HB3' HD12 ' A' ' 42' ' ' LEU . 35.1 m-85 -63.93 170.95 3.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.982 0.42 . . . . 0.0 111.607 -177.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.6 m -106.84 129.15 54.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.532 0.682 . . . . 0.0 112.448 -172.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.515 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . 23.8 p90 -55.64 -33.63 64.23 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.733 -173.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -59.6 -50.36 74.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.375 -177.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.659 ' CB ' HG11 ' A' ' 46' ' ' VAL . 2.5 m-20 -82.15 -23.58 35.51 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.941 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.593 HD13 ' HG2' ' A' ' 15' ' ' MET . 44.3 mt -59.0 -50.41 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.439 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -62.03 -36.13 80.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.57 176.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.695 ' O ' HG22 ' A' ' 29' ' ' VAL . 9.7 ttpp -61.73 -43.44 98.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.179 177.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.804 ' HB1' ' HA ' ' A' ' 38' ' ' ALA . . . -58.94 -41.1 86.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.837 177.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 25' ' ' GLN . 27.6 mt -63.19 -38.31 90.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.891 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.695 HG22 ' O ' ' A' ' 26' ' ' LYS . 4.2 m -67.55 -30.51 49.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.443 -176.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.868 HD12 HG13 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -86.13 -24.97 6.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.831 0.824 . . . . 0.0 109.284 174.746 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.841 ' CB ' ' HB3' ' A' ' 37' ' ' MET . . . -87.72 3.96 45.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.459 -175.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.55 HE21 ' ND2' ' A' ' 34' ' ' ASN . 2.2 pm0 43.67 40.15 2.82 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.532 0.682 . . . . 0.0 110.226 -171.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.2 m120 61.47 39.47 14.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.347 -1.297 . . . . 0.0 112.146 -177.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.55 ' ND2' HE21 ' A' ' 32' ' ' GLN . 58.2 m-20 -83.13 140.75 32.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.709 0.29 . . . . 0.0 110.48 172.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.506 HG12 ' HE3' ' A' ' 39' ' ' LYS . 6.0 tt -59.05 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.199 176.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.504 ' H ' HG23 ' A' ' 35' ' ' ILE . 40.4 mt-10 -72.12 -42.78 65.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.935 -175.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.841 ' HB3' ' CB ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER -61.14 -34.17 74.57 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.423 -175.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.804 ' HA ' ' HB1' ' A' ' 27' ' ' ALA . . . -70.27 -52.15 25.13 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.481 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE3' HG12 ' A' ' 35' ' ' ILE . 18.0 ptpt -63.12 -29.21 70.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.722 178.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 43' ' ' ARG . 78.1 m-20 -80.52 -39.26 28.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.502 -178.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.868 HG13 HD12 ' A' ' 30' ' ' ILE . 11.0 mm -66.15 -38.24 81.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.186 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -60.76 -46.35 90.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 0.1 OUTLIER -53.71 -35.84 61.59 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.475 176.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.42 -32.63 22.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.975 0.417 . . . . 0.0 112.077 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 13.7 m-85 -108.46 -76.04 0.62 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -171.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.659 HG11 ' CB ' ' A' ' 23' ' ' ASP . 0.2 OUTLIER -98.67 126.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.191 -171.017 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.7 m -100.24 176.16 5.48 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.98 -177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.422 HG22 ' H ' ' A' ' 49' ' ' SER . 0.5 OUTLIER -92.37 -154.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.903 -176.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.422 ' H ' HG22 ' A' ' 48' ' ' ILE . 66.2 m 60.66 46.9 8.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.419 0.628 . . . . 0.0 110.967 -175.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.505 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 20.7 p -82.59 128.55 66.13 Favored Pre-proline 0 N--CA 1.45 -0.455 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.975 177.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 50' ' ' SER . 1.1 Cg_endo -85.09 -86.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 122.798 2.332 . . . . 0.0 113.103 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.95 157.9 42.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.458 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 55.34 55.72 7.14 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 123.919 0.762 . . . . 0.0 109.674 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.45 HG11 ' HB2' ' A' ' 50' ' ' SER . 34.4 m -86.67 -2.02 7.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.404 -0.817 . . . . 0.0 112.635 -170.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.72 -74.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 t . . . . . 0 C--O 1.251 1.174 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.244 179.867 . . . . . . . . 0 0 . 1 stop_ save_