data_2knz_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 2knz _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.578 0.704 . . . . 3.21 109.438 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.888 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.0 m-30 -62.06 -55.15 31.97 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 114.959 -1.019 . . . . 0.91000000000000003 111.392 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.467 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 30.7 tt0 -62.5 -30.7 71.47 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.03 0.206 . . . . 1.9199999999999999 111.195 -170.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -73.19 -44.9 59.05 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.103 -0.702 . . . . 1.1899999999999999 109.103 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.625 ' CB ' HD23 ' A' ' 33' ' ' LEU . 1.2 mp0 -62.49 -24.98 67.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.387 -0.824 . . . . 1.24 109.996 171.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.79 HD23 ' HB3' ' A' ' 29' ' ' ASN . 12.2 mt -72.47 -35.23 68.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.227 -0.442 . . . . 1.05 110.077 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.58 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 27.1 mt-10 -67.07 -34.36 77.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.85 0.833 . . . . 0.88 109.639 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 20' ' ' SER . 9.2 tt0 -66.82 -46.8 74.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.497 178.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.535 HD21 HG12 ' A' ' 44' ' ' ILE . 52.4 mt -67.0 -32.5 73.78 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.918 0.866 . . . . 1.02 109.22 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.8 t30 -56.53 -28.21 59.47 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.976 -1.466 . . . . 0.29999999999999999 110.524 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.478 ' HB2' ' O ' ' A' ' 17' ' ' GLN . 71.2 m -81.06 -19.56 43.49 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.92 -1.491 . . . . 1.29 110.112 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.523 ' HE2' HD12 ' A' ' 44' ' ' ILE . 5.5 mmm -98.75 3.79 47.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.18 -1.373 . . . . 2.0699999999999998 110.55 -172.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.9 16.75 55.75 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.231 -0.895 . . . . 0.20000000000000001 111.073 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.497 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 59.6 m-85 -108.01 104.28 13.69 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.362 0.601 . . . . 0.45000000000000001 109.591 177.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.458 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -121.46 4.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.47 -0.786 . . . . 1.0800000000000001 110.895 -175.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.438 ' HB3' ' HB1' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -78.47 81.8 4.78 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.59 -1.633 . . . . 2.52 106.59 171.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.756 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.0 mmp_? -43.01 -48.63 6.02 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.839 0.712 . . . . 2.0600000000000001 110.926 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -45.73 -57.72 4.03 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.249 0.968 . . . . 2.4399999999999999 111.161 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.438 ' HB1' ' HB3' ' A' ' 25' ' ' ASN . . . -63.73 -49.48 72.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.524 -0.307 . . . . 1.1100000000000001 110.987 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.79 ' HB3' HD23 ' A' ' 15' ' ' LEU . 3.7 m-20 -48.28 -62.9 1.25 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 123.77 0.669 . . . . 0.16 111.551 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.4 pp -75.08 -24.48 58.16 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.173 -0.611 . . . . 1.0800000000000001 112.294 -173.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.469 ' N ' HD11 ' A' ' 30' ' ' LEU . 10.1 mm100 -64.98 -32.64 74.47 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 122.057 0.932 . . . . 2.8999999999999999 109.399 174.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.75 ' HA ' ' NH1' ' A' ' 46' ' ' ARG . . . -70.84 -38.19 73.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.314 -1.312 . . . . 0.97999999999999998 107.835 177.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.888 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.0 OUTLIER -73.47 -21.8 60.33 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.719 -1.128 . . . . 1.04 111.596 176.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.675 HG13 ' O ' ' A' ' 30' ' ' LEU . 12.0 mt -68.29 -49.65 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 N-CA-C 109.801 -0.444 . . . . 1.1299999999999999 109.801 176.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.509 ' HB3' ' NH1' ' A' ' 46' ' ' ARG . . . -76.66 -14.23 59.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.939 -0.573 . . . . 0.97999999999999998 112.069 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.824 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 70.7 p -104.55 -18.25 14.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.757 -0.377 . . . . 1.0 111.694 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.16 35.04 87.95 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.51 -0.314 . . . . 0.28999999999999998 113.372 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.1 10.47 36.67 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.325 -0.941 . . . . 0.37 111.364 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.824 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.2 t0 -94.09 87.14 5.2 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.241 -1.763 . . . . 0.64000000000000001 106.241 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.756 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.74 -24.18 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 CA-C-N 114.644 -1.162 . . . . 1.27 111.058 -170.403 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -63.56 -52.2 62.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.716 -0.846 . . . . 1.29 108.716 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.72 -32.49 71.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.044 -0.98 . . . . 1.02 110.483 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -51.71 -51.71 53.93 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.573 0.225 . . . . 1.04 110.722 172.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.756 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.3 mt -61.32 -47.26 94.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 109.844 -0.428 . . . . 1.1200000000000001 109.844 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.8 -20.67 65.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.414 . . . . 2.3500000000000001 111.386 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.75 ' NH1' ' HA ' ' A' ' 32' ' ' ALA . 42.8 mtp180 -80.17 -34.67 37.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.883 0.373 . . . . 3.1699999999999999 110.549 174.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.6 mt . . . . . 0 C--N 1.317 -0.829 0 CA-C-O 121.32 0.581 . . . . 1.0800000000000001 110.416 177.613 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 . . . . . 0 C--O 1.234 0.255 0 CA-C-O 121.229 0.538 . . . . 3.21 110.069 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.773 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.8 m-85 -61.48 -54.79 38.66 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.744 -0.662 . . . . 0.91000000000000003 111.845 -172.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.605 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 32.2 tt0 -59.72 -40.84 89.33 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.529 0.204 . . . . 1.9199999999999999 111.197 -170.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -62.04 -48.0 82.21 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.499 0.666 . . . . 1.1899999999999999 110.009 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.697 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.7 OUTLIER -66.45 -26.25 67.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.154 -0.93 . . . . 1.24 111.008 177.044 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.901 HD12 ' HB3' ' A' ' 30' ' ' LEU . 36.6 mt -73.35 -35.17 65.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 1.05 111.313 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 27.3 mt-10 -73.03 -27.15 61.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.558 0.694 . . . . 0.88 109.567 174.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.481 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.2 tt0 -65.09 -52.77 53.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.209 -0.905 . . . . 0.37 109.931 173.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.677 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 73.1 mt -62.49 -38.25 89.14 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.837 0.827 . . . . 1.02 108.982 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.3 t30 -49.87 -36.65 27.93 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.927 -1.488 . . . . 0.29999999999999999 110.575 176.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 t -86.36 -19.3 29.97 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.949 -1.023 . . . . 1.29 110.227 -177.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.677 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 24.6 mmm -73.99 -19.97 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.122 -0.945 . . . . 2.0699999999999998 110.016 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.24 15.63 15.44 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 110.57 -1.012 . . . . 0.20000000000000001 110.57 -172.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 65.8 m-85 -113.65 107.2 15.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.075 0.464 . . . . 0.45000000000000001 110.206 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.478 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -124.84 8.9 4.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.898 -0.592 . . . . 1.0800000000000001 110.847 -174.821 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.532 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -76.12 79.68 2.94 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.242 -1.392 . . . . 2.52 107.242 172.143 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.726 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -46.73 -45.83 19.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 123.66 0.6 . . . . 2.0600000000000001 111.193 -173.235 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 31' ' ' GLN . 2.3 mp0 -55.68 -46.98 77.48 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.858 0.724 . . . . 2.4399999999999999 110.442 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -70.39 -44.32 68.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.338 -0.392 . . . . 1.1100000000000001 110.269 -179.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.641 ' HB3' HD21 ' A' ' 15' ' ' LEU . 6.2 m-20 -54.0 -64.16 0.92 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.551 -0.75 . . . . 0.16 111.089 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.901 ' HB3' HD12 ' A' ' 15' ' ' LEU . 0.9 OUTLIER -73.56 -25.32 60.32 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.287 -0.565 . . . . 1.0800000000000001 111.794 -172.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -66.76 -28.56 68.5 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 118.542 0.61 . . . . 2.8999999999999999 110.109 175.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.84 -32.9 62.05 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.928 -1.138 . . . . 0.97999999999999998 107.928 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.627 HD22 ' HA ' ' A' ' 11' ' ' PHE . 2.1 mp -76.82 -20.52 56.26 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.82 -1.082 . . . . 1.04 111.286 174.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.756 HG13 ' O ' ' A' ' 30' ' ' LEU . 23.9 mt -73.89 -38.99 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.129 -0.693 . . . . 1.1299999999999999 109.129 176.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.81 -21.34 47.88 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.26 -0.882 . . . . 0.97999999999999998 111.471 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.492 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 43.6 p -103.78 -18.74 14.55 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.922 0.391 . . . . 1.0 111.808 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.18 29.96 68.01 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.28999999999999998 113.67 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.74 20.84 10.26 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.085 -1.055 . . . . 0.37 111.969 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.492 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 10.7 t0 -104.1 89.63 3.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.837 -1.542 . . . . 0.64000000000000001 106.837 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.794 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.23 -26.14 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 114.414 -1.267 . . . . 1.27 111.597 -168.835 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -50.02 71.49 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.668 -0.864 . . . . 1.29 108.668 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.09 -33.06 73.83 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.098 -0.956 . . . . 1.02 110.55 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.45 -49.27 67.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.676 -0.238 . . . . 1.04 111.017 172.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -65.01 -39.92 87.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 N-CA-C 109.919 -0.4 . . . . 1.1200000000000001 109.919 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.0 -24.43 67.03 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.007 -0.542 . . . . 2.3500000000000001 110.858 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 52.7 mtt180 -83.05 -33.37 26.46 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.862 -0.335 . . . . 3.1699999999999999 110.855 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--N 1.321 -0.648 0 CA-C-O 120.916 0.389 . . . . 1.0800000000000001 111.144 179.579 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 . . . . . 0 C--O 1.24 0.581 0 CA-C-O 121.763 0.792 . . . . 3.21 109.13 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.648 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.5 m-30 -61.97 -55.47 29.04 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 114.81 -1.086 . . . . 0.91000000000000003 111.462 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.5 tt0 -59.8 -33.28 71.52 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.836 -0.346 . . . . 1.9199999999999999 111.642 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -62.83 -48.87 77.19 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.702 0.763 . . . . 1.1899999999999999 109.403 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.504 ' CB ' HD23 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -68.89 -21.09 64.26 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.091 -0.959 . . . . 1.24 111.022 174.926 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.769 HD22 ' HB3' ' A' ' 29' ' ' ASN . 13.6 mt -74.37 -30.78 62.12 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 110.161 -0.311 . . . . 1.05 110.161 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.624 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 31.3 mt-10 -72.31 -30.0 64.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.886 0.85 . . . . 0.88 109.324 172.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.646 ' HG2' ' HE2' ' A' ' 21' ' ' MET . 9.5 tt0 -66.44 -48.56 69.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.272 -0.876 . . . . 0.37 110.198 174.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.861 ' HG ' HD13 ' A' ' 40' ' ' ILE . 71.8 mt -68.73 -31.49 70.59 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.941 -0.763 . . . . 1.02 108.941 177.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 8.6 t30 -50.22 -37.21 34.35 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.202 -1.363 . . . . 0.29999999999999999 109.817 173.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -86.68 -4.52 59.19 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.31 -1.314 . . . . 1.29 110.67 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.772 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 30.6 mtt -96.12 -9.2 31.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.542 0.687 . . . . 2.0699999999999998 109.223 178.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.2 15.99 36.65 Favored Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.008 -0.996 . . . . 0.20000000000000001 111.369 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.428 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 34.6 m-85 -108.84 110.64 22.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.411 0.624 . . . . 0.45000000000000001 110.032 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.47 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.57 1.83 4.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 115.291 -0.868 . . . . 1.0800000000000001 111.285 -174.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.463 ' ND2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -72.05 78.05 0.93 Allowed 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.368 -1.345 . . . . 2.52 107.368 165.124 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.781 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 15.9 mmt85 -47.45 -35.3 8.36 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.964 -1.017 . . . . 2.0600000000000001 109.95 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 35.9 mt-10 -53.31 -61.99 1.94 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.033 -0.985 . . . . 2.4399999999999999 111.71 173.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.463 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . . . -70.82 -37.0 73.19 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.064 -0.254 . . . . 1.1100000000000001 110.598 -174.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.769 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.3 m-20 -49.67 -64.3 0.85 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.036 -0.529 . . . . 0.16 110.639 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.781 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.8 pp -74.74 -24.81 58.77 Favored 'General case' 0 C--O 1.212 -0.918 0 C-N-CA 119.852 -0.739 . . . . 1.0800000000000001 112.323 -173.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.476 ' N ' HD13 ' A' ' 30' ' ' LEU . 13.1 mm100 -61.25 -34.78 75.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.683 0.754 . . . . 2.8999999999999999 109.406 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.71 -33.5 64.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.503 -1.226 . . . . 0.97999999999999998 108.784 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.757 HD21 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -76.56 -20.76 56.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.326 -0.852 . . . . 1.04 110.975 175.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.729 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.4 mt -70.12 -41.25 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 109.118 -0.697 . . . . 1.1299999999999999 109.118 174.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.93 -33.48 70.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.386 -0.825 . . . . 0.97999999999999998 111.267 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.727 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 80.7 p -96.12 -18.81 19.86 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.956 0.354 . . . . 1.0 111.956 -177.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.68 33.02 56.59 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.28999999999999998 112.717 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.757 ' HA2' HD21 ' A' ' 33' ' ' LEU . . . 95.45 10.8 56.59 Favored Glycine 0 CA--C 1.499 -0.951 0 C-N-CA 120.476 -0.869 . . . . 0.37 111.229 176.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.727 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.8 t70 -87.66 88.66 7.73 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 106.43 -1.693 . . . . 0.64000000000000001 106.43 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.861 HD13 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -70.86 -22.4 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.025 -0.989 . . . . 1.27 111.738 -166.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.99 -51.41 66.94 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.611 -0.885 . . . . 1.29 108.611 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -65.8 -34.1 77.38 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.725 -1.125 . . . . 1.02 109.95 177.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.86 79.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.266 -0.424 . . . . 1.04 111.496 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.83 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.0 mt -62.9 -45.77 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 N-CA-C 109.96 -0.385 . . . . 1.1200000000000001 109.96 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 42' ' ' ALA . 9.3 pt-20 -69.26 -19.41 63.92 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.495 -0.482 . . . . 2.3500000000000001 110.593 -177.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 48.0 mtt180 -78.17 -35.8 48.31 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 120.58 -0.448 . . . . 3.1699999999999999 109.981 173.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.292 -0.413 . . . . 1.0800000000000001 110.71 178.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 . . . . . 0 C--O 1.238 0.451 0 N-CA-C 108.723 -0.843 . . . . 3.21 108.723 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.684 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.7 m-30 -61.2 -50.74 71.88 Favored 'General case' 0 C--O 1.214 -0.801 0 CA-C-N 114.515 -1.22 . . . . 0.91000000000000003 109.92 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.0 tt0 -56.01 -39.46 71.95 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 123.207 0.317 . . . . 1.9199999999999999 111.389 -177.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -63.37 -44.86 93.58 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.671 0.748 . . . . 1.1899999999999999 109.502 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.629 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.0 OUTLIER -73.66 -19.28 60.88 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.189 -0.914 . . . . 1.24 111.216 175.166 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.934 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.6 mt -77.88 -36.24 49.94 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 110.04 -0.355 . . . . 1.05 110.04 -178.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.585 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 29.0 mt-10 -70.79 -29.02 65.1 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.77 0.669 . . . . 0.88 109.64 172.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -66.28 -51.7 54.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.37 110.045 174.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.836 ' HG ' HD13 ' A' ' 40' ' ' ILE . 79.5 mt -63.61 -34.74 78.5 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.938 0.875 . . . . 1.02 108.885 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.621 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.2 t30 -53.19 -34.87 58.81 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.902 -1.499 . . . . 0.29999999999999999 110.266 175.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.4 t -86.8 -12.01 49.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.625 -1.17 . . . . 1.29 110.01 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.613 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.9 mmm -90.86 -5.55 55.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.266 -0.879 . . . . 2.0699999999999998 109.892 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.17 15.99 39.61 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.323 -0.853 . . . . 0.20000000000000001 111.195 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.449 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.4 m-85 -111.42 107.41 16.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.135 0.493 . . . . 0.45000000000000001 109.771 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.472 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -127.29 8.44 3.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.802 -0.635 . . . . 1.0800000000000001 111.322 -173.622 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -82.96 85.7 7.1 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 106.423 -1.695 . . . . 2.52 106.423 170.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.828 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.2 mmp_? -42.81 -47.52 5.53 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.069 0.856 . . . . 2.0600000000000001 110.555 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -44.39 -57.1 3.73 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.587 1.18 . . . . 2.4399999999999999 111.275 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.09 64.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.888 0.375 . . . . 1.1100000000000001 110.347 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.759 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.7 -65.03 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.162 -0.926 . . . . 0.16 111.556 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.934 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.7 pp -73.15 -28.11 62.05 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 119.126 -0.464 . . . . 1.0800000000000001 111.969 -172.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.564 ' N ' HD11 ' A' ' 30' ' ' LEU . 18.5 mt-30 -60.09 -37.02 78.71 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.731 0.776 . . . . 2.8999999999999999 109.678 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.426 ' HB3' ' HA ' ' A' ' 43' ' ' ALA . . . -72.17 -31.67 66.14 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.363 -1.29 . . . . 0.97999999999999998 108.814 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.733 HD22 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -79.33 -19.59 49.98 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.218 -0.901 . . . . 1.04 111.17 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.1 mt -71.09 -44.18 75.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.777 -0.823 . . . . 1.1299999999999999 108.777 173.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.97 -27.21 66.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.202 -0.908 . . . . 0.97999999999999998 111.287 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.814 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 54.7 p -101.73 -19.38 15.4 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.53 0.567 . . . . 1.0 112.53 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.52 26.12 72.53 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.06 -0.59 . . . . 0.28999999999999998 112.201 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.733 ' HA2' HD22 ' A' ' 33' ' ' LEU . . . 98.44 18.76 25.07 Favored Glycine 0 CA--C 1.5 -0.855 0 C-N-CA 120.66 -0.781 . . . . 0.37 111.472 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.814 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 18.4 t70 -94.04 87.87 5.48 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.395 -1.705 . . . . 0.64000000000000001 106.395 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.836 HD13 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -68.94 -23.92 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 114.849 -1.068 . . . . 1.27 110.923 -166.735 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 60.3 m-20 -52.51 -57.39 10.07 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.25 0.548 . . . . 1.29 109.717 173.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.441 ' HB1' ' CG2' ' A' ' 36' ' ' THR . . . -72.55 -22.32 61.03 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.319 -0.855 . . . . 1.02 111.09 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 32' ' ' ALA . . . -58.23 -48.63 79.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 121.162 -0.215 . . . . 1.04 110.585 168.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.436 HD13 ' CE ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -70.74 -32.98 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 120.544 -0.462 . . . . 1.1200000000000001 110.753 177.873 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 6.9 mm-40 -61.61 -22.72 65.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.087 0.47 . . . . 2.3500000000000001 110.098 174.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -88.76 -44.59 10.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.954 -0.566 . . . . 3.1699999999999999 111.195 175.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-O 120.855 0.359 . . . . 1.0800000000000001 111.678 -179.473 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 . . . . . 0 C--O 1.242 0.66 0 N-CA-C 108.76 -0.83 . . . . 3.21 108.76 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.751 ' HA ' HD23 ' A' ' 33' ' ' LEU . 17.7 m-30 -62.55 -55.28 28.78 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 114.937 -1.029 . . . . 0.91000000000000003 111.968 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.472 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 50.8 tt0 -56.97 -42.43 80.16 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.778 0.288 . . . . 1.9199999999999999 111.778 -172.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.408 ' HA ' ' NE2' ' A' ' 13' ' ' GLN . 20.0 mm-40 -60.17 -45.75 92.01 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.649 0.737 . . . . 1.1899999999999999 110.181 178.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.688 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -72.77 -21.0 61.07 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.892 -1.049 . . . . 1.24 111.444 176.348 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.757 HD22 ' HB3' ' A' ' 29' ' ' ASN . 11.8 mt -73.73 -37.6 65.06 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.267 -0.271 . . . . 1.05 110.267 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 29.8 mt-10 -69.68 -28.7 66.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.721 0.772 . . . . 0.88 109.376 174.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' A' ' 21' ' ' MET . 9.1 tt0 -67.51 -46.33 73.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.407 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 42.6 mt -67.56 -31.9 72.29 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.082 0.944 . . . . 1.02 108.914 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.3 t30 -57.07 -30.5 64.34 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 113.633 -1.621 . . . . 0.29999999999999999 109.966 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -83.11 -19.8 36.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.478 -1.237 . . . . 1.29 109.9 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.531 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 13.3 mmt -80.18 -17.55 52.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.135 -0.939 . . . . 2.0699999999999998 109.889 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.25 13.45 28.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.391 -1.083 . . . . 0.20000000000000001 110.391 -171.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -105.14 108.89 20.65 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.298 0.57 . . . . 0.45000000000000001 110.856 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.563 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -125.33 13.02 4.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.627 -0.715 . . . . 1.0800000000000001 111.367 -174.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 3.2 t30 -84.99 80.25 9.36 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 106.736 -1.579 . . . . 2.52 106.736 173.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.756 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.1 mmp_? -43.18 -49.23 6.53 Favored 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.934 0.771 . . . . 2.0600000000000001 111.322 -174.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -47.73 -55.93 8.46 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 124.602 1.189 . . . . 2.4399999999999999 110.537 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -66.75 -46.91 73.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.144 -0.48 . . . . 1.1100000000000001 110.744 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.757 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.05 -64.23 0.85 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.641 -0.709 . . . . 0.16 111.31 177.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.6 pp -71.84 -27.31 62.81 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 120.376 -0.53 . . . . 1.0800000000000001 111.976 -174.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.5 ' N ' HD13 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.03 -30.85 71.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.348 0.594 . . . . 2.8999999999999999 109.93 176.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.88 -32.89 61.98 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.574 -0.899 . . . . 0.97999999999999998 108.574 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.751 HD23 ' HA ' ' A' ' 11' ' ' PHE . 1.9 mp -73.95 -23.7 59.54 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.21 -0.905 . . . . 1.04 111.334 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.4 mt -72.18 -37.55 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.278 -0.638 . . . . 1.1299999999999999 109.278 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.8 -27.5 60.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.723 -0.671 . . . . 0.97999999999999998 111.305 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.65 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 66.0 p -99.95 -17.96 17.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.696 -177.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.99 29.77 70.5 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.28999999999999998 113.056 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.03 22.0 10.44 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 119.979 -1.105 . . . . 0.37 111.48 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.65 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t0 -104.51 89.09 3.11 Favored 'General case' 0 CA--C 1.499 -1.011 0 N-CA-C 106.597 -1.631 . . . . 0.64000000000000001 106.597 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.684 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -66.95 -25.14 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 CA-C-N 114.374 -1.285 . . . . 1.27 111.599 -168.316 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.18 -49.34 74.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.579 -0.897 . . . . 1.29 108.579 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.612 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -67.95 -33.43 74.64 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.851 -1.068 . . . . 1.02 110.077 177.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.49 67.65 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 111.376 0.139 . . . . 1.04 111.376 173.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -40.14 87.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 CA-C-O 120.744 0.306 . . . . 1.1200000000000001 110.226 178.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -67.9 -19.62 65.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.233 -0.44 . . . . 2.3500000000000001 110.585 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 57.3 mtp85 -77.79 -47.73 18.24 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.158 -0.617 . . . . 3.1699999999999999 109.597 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.3 mt . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.272 -0.876 . . . . 1.0800000000000001 111.485 -177.013 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 . . . . . 0 C--O 1.242 0.659 0 CA-C-O 121.663 0.744 . . . . 3.21 110.001 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.653 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 12.5 m-30 -62.39 -54.91 33.43 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 115.005 -0.998 . . . . 0.91000000000000003 112.204 -174.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 8.8 tt0 -58.84 -36.87 75.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.197 -0.201 . . . . 1.9199999999999999 111.049 -173.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -64.18 -41.46 97.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.813 0.816 . . . . 1.1899999999999999 109.937 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.772 ' HB3' HG13 ' A' ' 40' ' ' ILE . 33.4 mt-30 -74.98 -21.12 59.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.118 -0.946 . . . . 1.24 110.931 175.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.876 HD12 ' HB3' ' A' ' 30' ' ' LEU . 20.1 mt -75.46 -36.67 60.65 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.591 -0.277 . . . . 1.05 110.317 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.6 mt-10 -73.43 -26.02 60.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.499 0.666 . . . . 0.88 109.975 174.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.97 -50.87 60.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.267 -0.878 . . . . 0.37 109.723 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.843 ' HG ' HD11 ' A' ' 40' ' ' ILE . 33.0 mt -63.37 -34.71 78.31 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.9 0.857 . . . . 1.02 109.135 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.4 t30 -53.92 -34.93 60.99 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.031 -1.441 . . . . 0.29999999999999999 110.275 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 t -87.23 -6.2 58.66 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.558 -1.201 . . . . 1.29 109.822 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.56 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 7.2 mmm -98.33 -4.72 34.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.966 -1.016 . . . . 2.0699999999999998 109.864 -178.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.69 18.23 33.24 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.3 -0.864 . . . . 0.20000000000000001 111.295 -177.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.456 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 60.8 m-85 -113.4 109.32 18.5 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.116 0.484 . . . . 0.45000000000000001 109.764 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.532 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -126.98 0.88 3.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.054 -0.521 . . . . 1.0800000000000001 111.596 -172.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.69 82.31 3.32 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.117 -1.438 . . . . 2.52 107.117 171.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.785 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.5 mmp_? -41.64 -49.0 4.19 Favored 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 124.011 0.819 . . . . 2.0600000000000001 110.933 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 2.4 mm-40 -43.59 -58.57 2.58 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.729 1.268 . . . . 2.4399999999999999 110.588 176.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.83 -49.23 63.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 1.1100000000000001 110.723 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.752 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.1 m-20 -45.55 -64.25 0.77 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.745 0.653 . . . . 0.16 111.385 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.876 ' HB3' HD12 ' A' ' 15' ' ' LEU . 2.1 pp -72.99 -27.01 61.55 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-O 119.006 -0.521 . . . . 1.0800000000000001 112.189 -173.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.502 ' N ' HD13 ' A' ' 30' ' ' LEU . 23.6 mm-40 -60.78 -35.33 76.16 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.711 0.767 . . . . 2.8999999999999999 109.389 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -73.12 -33.16 65.38 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.563 -1.199 . . . . 0.97999999999999998 108.718 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.61 HD21 ' CB ' ' A' ' 14' ' ' GLN . 2.3 mp -75.84 -25.61 56.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.164 -0.926 . . . . 1.04 111.387 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 30' ' ' LEU . 5.3 mt -73.99 -32.71 34.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.394 0.616 . . . . 1.1299999999999999 109.391 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.61 ' HB2' ' NH1' ' A' ' 46' ' ' ARG . . . -79.55 -23.54 42.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.455 -0.793 . . . . 0.97999999999999998 111.139 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.43 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 45.7 p -104.79 -17.98 14.41 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.214 0.45 . . . . 1.0 112.214 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.72 32.21 70.61 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 121.408 -0.425 . . . . 0.28999999999999998 113.051 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.93 37.88 5.06 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 119.884 -1.15 . . . . 0.37 111.43 176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.43 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t70 -119.38 87.11 2.68 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 106.119 -1.808 . . . . 0.64000000000000001 106.119 172.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.866 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -65.55 -24.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.557 0 CA-C-N 113.836 -1.529 . . . . 1.27 111.644 -166.597 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -62.03 -50.44 72.01 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.938 -0.764 . . . . 1.29 108.938 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.573 ' O ' ' HG3' ' A' ' 45' ' ' GLU . . . -68.88 -32.13 71.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.876 -1.056 . . . . 1.02 110.367 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -56.14 -49.85 72.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 121.26 -0.176 . . . . 1.04 110.882 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.866 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.6 mt -63.29 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.699 0.285 . . . . 1.1200000000000001 110.812 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -72.99 -19.6 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.745 -0.382 . . . . 2.3500000000000001 110.585 -176.3 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.61 ' NH1' ' HB2' ' A' ' 35' ' ' ALA . 75.3 mtt180 -84.85 -27.11 26.95 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.974 0.416 . . . . 3.1699999999999999 110.409 173.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 96.2 mt . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 1.0800000000000001 110.071 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? . . . . . 0 C--O 1.238 0.45 0 CA-C-O 121.581 0.705 . . . . 3.21 109.156 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.777 ' HA ' HD23 ' A' ' 33' ' ' LEU . 19.2 m-30 -61.54 -54.6 40.93 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.849 -1.069 . . . . 0.91000000000000003 111.375 -172.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.618 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.9 tt0 -59.54 -34.34 72.52 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 121.235 -0.186 . . . . 1.9199999999999999 111.492 -172.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.02 -47.42 77.5 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.578 0.704 . . . . 1.1899999999999999 109.427 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.716 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.1 mp0 -69.6 -19.28 63.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.282 -0.872 . . . . 1.24 111.203 174.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.669 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.5 mt -73.75 -40.2 63.67 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.621 -0.511 . . . . 1.05 109.621 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 33.3 mt-10 -64.54 -31.35 72.53 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.827 0.822 . . . . 0.88 109.59 173.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.504 ' NE2' HG21 ' A' ' 40' ' ' ILE . 8.1 tt0 -66.83 -50.63 61.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.096 -0.956 . . . . 0.37 111.056 175.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.667 HD23 HG12 ' A' ' 44' ' ' ILE . 62.0 mt -66.37 -30.15 70.47 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.854 0.835 . . . . 1.02 108.871 177.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.615 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.9 t30 -54.23 -35.29 62.3 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.051 -1.431 . . . . 0.29999999999999999 110.3 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 t -87.1 -3.74 59.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.727 -1.124 . . . . 1.29 110.027 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.729 ' HE2' HD13 ' A' ' 44' ' ' ILE . 31.6 mmm -97.48 -8.38 29.38 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.306 -0.861 . . . . 2.0699999999999998 109.718 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.28 16.89 33.39 Favored Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.27 -0.877 . . . . 0.20000000000000001 111.153 -176.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.471 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.3 m-85 -110.63 109.52 19.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.45000000000000001 109.879 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.76 -8.06 10.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.764 -0.653 . . . . 1.0800000000000001 111.43 -172.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -73.13 83.14 1.3 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.94 -1.504 . . . . 2.52 106.94 169.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.873 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 57.2 mtt85 -60.98 -26.01 67.26 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.218 -0.446 . . . . 2.0600000000000001 110.717 -175.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -52.76 -50.5 63.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.433 -0.58 . . . . 2.4399999999999999 109.433 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.52 -46.26 60.14 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.987 -0.551 . . . . 1.1100000000000001 110.421 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.558 ' CB ' HD22 ' A' ' 15' ' ' LEU . 6.6 m-20 -50.82 -60.41 3.09 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.659 -0.701 . . . . 0.16 111.268 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.873 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 2.0 pp -73.87 -24.22 59.71 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 120.294 -0.563 . . . . 1.0800000000000001 112.343 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.552 ' N ' HD11 ' A' ' 30' ' ' LEU . 17.4 mm-40 -60.85 -34.66 74.93 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.88 0.848 . . . . 2.8999999999999999 109.328 172.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -31.17 61.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.285 -1.325 . . . . 0.97999999999999998 108.176 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 11' ' ' PHE . 0.9 OUTLIER -79.68 -22.06 43.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.166 -0.925 . . . . 1.04 111.233 177.289 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.727 HG13 ' O ' ' A' ' 30' ' ' LEU . 6.0 mt -73.33 -38.5 53.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.641 -0.503 . . . . 1.1299999999999999 109.641 175.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.6 -22.16 54.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.852 -0.613 . . . . 0.97999999999999998 111.152 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.466 ' OG1' ' HA ' ' A' ' 33' ' ' LEU . 46.4 p -102.86 -18.78 14.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.338 0.496 . . . . 1.0 112.338 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.93 28.86 59.94 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 121.343 -0.456 . . . . 0.28999999999999998 113.241 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.725 ' HA2' HD22 ' A' ' 33' ' ' LEU . . . 103.07 10.17 37.54 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.103 -1.046 . . . . 0.37 111.487 176.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.458 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.3 t70 -96.52 87.88 4.53 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 107.117 -1.438 . . . . 0.64000000000000001 107.117 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.787 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -64.59 -25.72 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-N 114.11 -1.404 . . . . 1.27 111.536 -169.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 5.5 m-80 -60.51 -53.91 51.8 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.829 -0.804 . . . . 1.29 108.829 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.26 -30.9 70.04 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.437 -0.801 . . . . 1.02 110.559 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -46.32 74.0 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.395 -0.366 . . . . 1.04 110.543 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.787 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -68.13 -37.53 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.892 -0.41 . . . . 1.1200000000000001 109.892 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.481 ' HG3' ' O ' ' A' ' 41' ' ' ASN . 51.0 mt-10 -65.7 -21.12 66.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.93 -0.577 . . . . 2.3500000000000001 110.935 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 54.1 mtt180 -87.33 -40.95 14.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.312 -0.404 . . . . 3.1699999999999999 110.845 176.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.995 0.426 . . . . 1.0800000000000001 110.685 177.472 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 . . . . . 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 3.21 110.151 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.633 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 17.2 m-30 -61.44 -54.55 42.02 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 115.238 -0.892 . . . . 0.91000000000000003 110.318 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.522 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 8.6 tt0 -55.78 -35.56 66.39 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 123.368 0.417 . . . . 1.9199999999999999 111.51 -175.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -64.56 -49.65 70.38 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.566 0.698 . . . . 1.1899999999999999 109.267 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.49 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -68.75 -19.04 64.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.147 -0.933 . . . . 1.24 111.038 174.378 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.901 HD13 ' HB3' ' A' ' 30' ' ' LEU . 11.3 mt -75.97 -35.85 59.49 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 122.027 -0.42 . . . . 1.05 110.083 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.548 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 30.7 mt-10 -71.93 -25.6 61.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.538 0.685 . . . . 0.88 109.362 173.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -70.01 -46.28 65.44 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.444 -0.798 . . . . 0.37 110.569 174.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.88 ' HG ' HD11 ' A' ' 40' ' ' ILE . 63.7 mt -69.47 -33.56 73.08 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.281 -1.007 . . . . 1.02 108.281 177.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.595 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 6.1 t30 -51.8 -35.01 42.58 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.482 -1.69 . . . . 0.29999999999999999 110.146 173.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.6 t -86.57 -11.1 52.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.592 -1.186 . . . . 1.29 110.378 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.657 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.2 mmm -90.45 -13.26 35.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.716 -0.675 . . . . 2.0699999999999998 110.204 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.02 13.32 27.49 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-N 115.386 -0.825 . . . . 0.20000000000000001 111.349 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -111.12 107.96 17.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.244 0.545 . . . . 0.45000000000000001 110.392 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.492 ' N ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -123.79 6.22 5.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.94 -0.573 . . . . 1.0800000000000001 111.37 -174.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.473 ' ND2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -75.9 79.16 2.8 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.383 -1.339 . . . . 2.52 107.383 167.437 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.773 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 9.0 mmt85 -46.36 -39.48 10.4 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.574 -0.739 . . . . 2.0600000000000001 109.926 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -46.94 -62.19 1.52 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.649 -1.16 . . . . 2.4399999999999999 111.429 172.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.473 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . . . -72.77 -39.69 66.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.802 -0.359 . . . . 1.1100000000000001 110.76 -175.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.757 ' HB3' HD22 ' A' ' 15' ' ' LEU . 7.3 m-20 -49.34 -64.95 0.66 Allowed 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 123.284 0.365 . . . . 0.16 111.082 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.901 ' HB3' HD13 ' A' ' 15' ' ' LEU . 2.3 pp -74.98 -26.53 59.64 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 119.835 -0.746 . . . . 1.0800000000000001 112.364 -171.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.583 ' N ' HD11 ' A' ' 30' ' ' LEU . 23.4 mt-30 -63.65 -33.3 75.32 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.763 0.792 . . . . 2.8999999999999999 109.661 176.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.45 67.23 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.499 -1.228 . . . . 0.97999999999999998 108.541 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.717 HD22 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -74.78 -23.24 58.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.316 -0.857 . . . . 1.04 110.935 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.745 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.6 mt -70.72 -36.85 66.75 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.649 0.738 . . . . 1.1299999999999999 109.246 175.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.566 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -78.65 -20.52 50.08 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.055 -0.975 . . . . 0.97999999999999998 111.501 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.6 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 63.3 p -108.36 -19.1 13.58 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.852 -0.339 . . . . 1.0 111.817 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.8 26.46 58.54 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 121.473 -0.394 . . . . 0.28999999999999998 112.908 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.717 ' HA2' HD22 ' A' ' 33' ' ' LEU . . . 97.69 16.87 32.47 Favored Glycine 0 CA--C 1.497 -1.059 0 C-N-CA 120.2 -1.0 . . . . 0.37 111.311 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.6 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.0 t70 -93.13 93.06 8.08 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 105.405 -2.072 . . . . 0.64000000000000001 105.405 170.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.88 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.77 -25.05 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-N 114.862 -1.063 . . . . 1.27 111.355 -166.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -59.52 -52.03 67.29 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.295 -0.631 . . . . 1.29 109.295 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.591 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -69.8 -27.18 64.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.318 -0.855 . . . . 1.02 110.288 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.488 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -61.65 -49.2 77.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 1.04 110.859 173.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.825 HG13 ' O ' ' A' ' 40' ' ' ILE . 2.6 mt -65.88 -38.63 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 120.685 0.278 . . . . 1.1200000000000001 110.264 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 42' ' ' ALA . 6.4 pt-20 -66.71 -24.24 66.22 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.905 -0.318 . . . . 2.3500000000000001 110.487 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.591 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.0 mtt180 -82.17 -29.67 31.41 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.626 -0.43 . . . . 3.1699999999999999 110.091 175.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 44' ' ' ILE . 91.4 mt . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.263 -0.426 . . . . 1.0800000000000001 110.808 177.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 . . . . . 0 C--O 1.238 0.453 0 CA-C-O 121.32 0.581 . . . . 3.21 109.793 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.71 ' HA ' HD22 ' A' ' 33' ' ' LEU . 18.3 m-30 -62.36 -55.21 30.23 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.308 -0.86 . . . . 0.91000000000000003 111.679 -171.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.576 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 29.4 tt0 -58.68 -37.49 76.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 117.931 0.332 . . . . 1.9199999999999999 110.979 -171.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -59.8 -52.07 67.04 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 122.212 1.006 . . . . 1.1899999999999999 109.395 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.647 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -70.24 -20.04 63.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.182 -1.372 . . . . 1.24 111.365 178.289 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 30' ' ' LEU . 13.0 mt -74.92 -35.09 62.2 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 122.348 -0.22 . . . . 1.05 110.652 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 34.3 mt-10 -70.68 -29.84 66.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.786 0.803 . . . . 0.88 109.18 173.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.532 ' HG2' ' HE3' ' A' ' 21' ' ' MET . 9.3 tt0 -66.28 -48.14 71.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.976 -1.011 . . . . 0.37 110.489 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.853 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 67.1 mt -69.59 -31.86 70.26 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.849 -0.797 . . . . 1.02 108.849 177.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.7 t30 -50.92 -34.35 28.12 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.181 -1.372 . . . . 0.29999999999999999 110.062 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -86.71 -14.96 40.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.415 -1.266 . . . . 1.29 110.61 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.853 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 23.5 mtt -85.41 -10.76 55.78 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.488 0.661 . . . . 2.0699999999999998 109.961 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.34 10.91 43.5 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 110.808 -0.917 . . . . 0.20000000000000001 110.808 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.41 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.0 m-85 -107.73 109.32 20.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.582 0.706 . . . . 0.45000000000000001 110.625 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.455 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.53 9.8 3.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 115.554 -0.748 . . . . 1.0800000000000001 111.063 -174.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.522 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 2.3 t30 -79.34 79.8 5.76 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 106.882 -1.525 . . . . 2.52 106.882 172.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.77 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 58.7 mmt-85 -46.04 -44.46 15.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.891 0.745 . . . . 2.0600000000000001 111.948 -171.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.6 -49.98 75.67 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.514 0.508 . . . . 2.4399999999999999 110.304 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.522 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . . . -64.06 -47.77 78.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.18 -0.304 . . . . 1.1100000000000001 110.18 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.74 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.5 m-20 -48.48 -63.46 1.08 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.656 -0.702 . . . . 0.16 111.036 176.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' A' ' 15' ' ' LEU . 2.2 pp -73.8 -25.46 60.13 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 120.307 -0.557 . . . . 1.0800000000000001 112.395 -172.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.566 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.6 mt-30 -64.32 -32.48 74.1 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.753 0.787 . . . . 2.8999999999999999 109.848 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.4 -33.46 64.99 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.861 -1.063 . . . . 0.97999999999999998 108.591 176.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.775 HD21 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -75.19 -24.61 57.85 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.09 -0.959 . . . . 1.04 110.991 175.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.752 HG13 ' O ' ' A' ' 30' ' ' LEU . 26.4 mt -67.75 -48.29 76.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.363 -0.606 . . . . 1.1299999999999999 109.363 175.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.4 -28.0 68.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.432 -0.804 . . . . 0.97999999999999998 111.681 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.676 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 40.2 p -98.49 -18.76 18.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.865 0.364 . . . . 1.0 111.921 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.53 21.32 60.32 Favored Glycine 0 C--N 1.322 -0.23 0 C-N-CA 121.202 -0.523 . . . . 0.28999999999999998 112.346 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.775 ' HA2' HD21 ' A' ' 33' ' ' LEU . . . 95.77 16.5 38.94 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 111.047 -0.821 . . . . 0.37 111.047 -178.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.676 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 19.7 t70 -90.89 87.73 6.75 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 106.041 -1.837 . . . . 0.64000000000000001 106.041 175.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.845 HD13 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -73.54 -27.11 22.83 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.955 -1.02 . . . . 1.27 113.02 -158.495 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 8.8 p30 -60.97 -43.25 99.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.91 -0.774 . . . . 1.29 108.91 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -72.69 -30.6 64.36 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.022 -0.99 . . . . 1.02 110.639 176.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.52 91.53 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.468 -0.333 . . . . 1.04 110.83 172.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.1 mt -65.98 -38.71 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 N-CA-C 109.356 -0.609 . . . . 1.1200000000000001 109.356 176.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 21.5 mm-40 -58.19 -30.39 66.39 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.505 -0.77 . . . . 2.3500000000000001 110.41 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.3 mtp85 -77.96 -43.73 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.687 0.28 . . . . 3.1699999999999999 110.742 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.6 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 1.0800000000000001 111.493 -177.684 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 . . . . . 0 C--O 1.242 0.658 0 CA-C-O 122.041 0.924 . . . . 3.21 108.684 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.627 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 2.8 m-85 -60.88 -51.42 69.37 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.196 -1.366 . . . . 0.91000000000000003 110.182 -176.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.665 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 7.0 tt0 -58.24 -33.6 69.53 Favored 'General case' 0 C--O 1.222 -0.387 0 O-C-N 123.202 0.314 . . . . 1.9199999999999999 111.552 -174.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -65.3 -49.5 69.28 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.475 0.655 . . . . 1.1899999999999999 109.491 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.669 ' CB ' HD22 ' A' ' 33' ' ' LEU . 1.3 mp0 -66.97 -20.74 65.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.508 -0.769 . . . . 1.24 110.728 174.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.775 HD12 ' HB3' ' A' ' 30' ' ' LEU . 15.5 mt -78.18 -35.6 48.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.102 -0.499 . . . . 1.05 110.907 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.665 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.1 mt-10 -64.8 -34.29 78.01 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.78 0.8 . . . . 0.88 108.863 172.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.4 tt0 -63.92 -52.74 58.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.734 -1.121 . . . . 0.37 110.877 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.66 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 48.0 mt -64.67 -35.3 80.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.838 0.828 . . . . 1.02 109.128 177.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.601 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 7.6 t30 -53.95 -34.25 59.14 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.969 -1.469 . . . . 0.29999999999999999 110.371 176.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 t -87.06 -14.75 40.6 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.159 -1.382 . . . . 1.29 110.012 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.876 ' HE1' HD13 ' A' ' 44' ' ' ILE . 26.0 mmm -82.21 -17.77 44.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.007 -0.997 . . . . 2.0699999999999998 110.009 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.46 10.84 30.46 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.09 -0.959 . . . . 0.20000000000000001 110.943 -172.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -103.77 106.15 16.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.382 0.61 . . . . 0.45000000000000001 110.414 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.07 15.87 3.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.701 -0.681 . . . . 1.0800000000000001 111.469 -177.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.523 ' HB3' ' HB1' ' A' ' 28' ' ' ALA . 54.6 t30 -84.22 84.19 7.71 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.41 -1.7 . . . . 2.52 106.41 171.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.779 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mmp_? -45.85 -49.62 15.13 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 123.842 0.714 . . . . 2.0600000000000001 111.762 -172.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -53.89 -51.23 64.35 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 123.953 0.783 . . . . 2.4399999999999999 110.931 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' A' ' 25' ' ' ASN . . . -60.09 -52.66 64.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.689 0.281 . . . . 1.1100000000000001 110.293 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.748 ' HB3' HD21 ' A' ' 15' ' ' LEU . 4.6 m-20 -48.0 -64.34 0.82 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.46 -0.791 . . . . 0.16 111.568 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.7 pp -73.93 -25.04 59.76 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 120.432 -0.507 . . . . 1.0800000000000001 112.124 -172.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.458 ' N ' HD12 ' A' ' 30' ' ' LEU . 16.5 mt-30 -62.45 -35.64 79.94 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.865 0.841 . . . . 2.8999999999999999 109.295 174.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -71.98 -33.08 67.85 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.471 -1.24 . . . . 0.97999999999999998 108.49 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.669 HD22 ' CB ' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -78.01 -20.04 53.28 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.588 -1.187 . . . . 1.04 111.166 176.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.741 HG13 ' O ' ' A' ' 30' ' ' LEU . 34.6 mt -68.9 -49.08 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 109.053 -0.721 . . . . 1.1299999999999999 109.053 174.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.03 -20.66 60.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.491 -0.777 . . . . 0.97999999999999998 112.016 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.79 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 60.8 p -102.43 -18.72 15.24 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.874 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.74 26.13 74.76 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.315 -0.469 . . . . 0.28999999999999998 113.533 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.99 20.98 8.01 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.398 -0.906 . . . . 0.37 111.729 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.79 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 63.0 t0 -103.9 87.17 2.73 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 106.735 -1.579 . . . . 0.64000000000000001 106.735 176.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.651 ' HB ' ' CG ' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -65.85 -28.83 45.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-N 113.927 -1.488 . . . . 1.27 111.437 -167.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -61.43 -47.13 87.12 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.59 0.71 . . . . 1.29 109.251 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.65 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -75.25 -29.46 60.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.067 -0.97 . . . . 1.02 109.968 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.495 ' HA ' ' HB3' ' A' ' 32' ' ' ALA . . . -54.51 -45.07 73.22 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.757 0.313 . . . . 1.04 110.294 171.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.876 HD13 ' HE1' ' A' ' 21' ' ' MET . 0.9 OUTLIER -68.34 -37.85 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 109.646 -0.501 . . . . 1.1200000000000001 109.646 177.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -60.7 -20.09 60.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.892 -0.595 . . . . 2.3500000000000001 110.688 174.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.65 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 64.1 mtp85 -87.6 -42.42 12.72 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.595 -0.442 . . . . 3.1699999999999999 110.336 177.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 79.6 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.783 -0.644 . . . . 1.0800000000000001 110.665 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 112.093 -0.403 . . . . 7.0899999999999999 112.093 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.73 123.46 13.34 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.849 2.366 . . . . 7.1900000000000004 111.294 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 92.7 mt -84.74 110.62 18.92 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.931 -0.577 . . . . 4.9299999999999997 111.788 -173.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.01 -6.01 88.88 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.233 -0.747 . . . . 1.8799999999999999 111.233 171.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.0 m -87.0 47.68 1.54 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.942 0.877 . . . . 1.78 109.007 174.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.541 ' HE3' HG21 ' A' ' 9' ' ' VAL . 44.3 mtm -145.23 65.81 12.03 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.55 -1.648 . . . . 2.4100000000000001 106.55 174.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -52.31 -34.64 61.0 Favored 'Trans proline' 0 CA--C 1.522 -0.124 0 C-N-CA 123.519 2.813 . . . . 1.0600000000000001 114.685 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.635 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 26.0 mt-10 -68.56 -16.89 64.02 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 120.482 -0.487 . . . . 1.22 111.926 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.541 HG21 ' HE3' ' A' ' 6' ' ' MET . 74.0 t -65.59 -24.26 34.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.435 0.636 . . . . 1.26 109.701 175.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -102.13 -48.15 4.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.578 0.704 . . . . 3.21 109.438 171.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.888 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.0 m-30 -62.06 -55.15 31.97 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 114.959 -1.019 . . . . 0.91000000000000003 111.392 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.467 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 30.7 tt0 -62.5 -30.7 71.47 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.03 0.206 . . . . 1.9199999999999999 111.195 -170.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -73.19 -44.9 59.05 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.103 -0.702 . . . . 1.1899999999999999 109.103 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.625 ' CB ' HD23 ' A' ' 33' ' ' LEU . 1.2 mp0 -62.49 -24.98 67.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.387 -0.824 . . . . 1.24 109.996 171.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.79 HD23 ' HB3' ' A' ' 29' ' ' ASN . 12.2 mt -72.47 -35.23 68.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.227 -0.442 . . . . 1.05 110.077 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.58 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 27.1 mt-10 -67.07 -34.36 77.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.85 0.833 . . . . 0.88 109.639 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 20' ' ' SER . 9.2 tt0 -66.82 -46.8 74.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.497 178.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.535 HD21 HG12 ' A' ' 44' ' ' ILE . 52.4 mt -67.0 -32.5 73.78 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.918 0.866 . . . . 1.02 109.22 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.8 t30 -56.53 -28.21 59.47 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.976 -1.466 . . . . 0.29999999999999999 110.524 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.478 ' HB2' ' O ' ' A' ' 17' ' ' GLN . 71.2 m -81.06 -19.56 43.49 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.92 -1.491 . . . . 1.29 110.112 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.523 ' HE2' HD12 ' A' ' 44' ' ' ILE . 5.5 mmm -98.75 3.79 47.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.18 -1.373 . . . . 2.0699999999999998 110.55 -172.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.9 16.75 55.75 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.231 -0.895 . . . . 0.20000000000000001 111.073 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.497 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 59.6 m-85 -108.01 104.28 13.69 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.362 0.601 . . . . 0.45000000000000001 109.591 177.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.458 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -121.46 4.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.47 -0.786 . . . . 1.0800000000000001 110.895 -175.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.438 ' HB3' ' HB1' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -78.47 81.8 4.78 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.59 -1.633 . . . . 2.52 106.59 171.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.756 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.0 mmp_? -43.01 -48.63 6.02 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.839 0.712 . . . . 2.0600000000000001 110.926 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -45.73 -57.72 4.03 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.249 0.968 . . . . 2.4399999999999999 111.161 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.438 ' HB1' ' HB3' ' A' ' 25' ' ' ASN . . . -63.73 -49.48 72.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.524 -0.307 . . . . 1.1100000000000001 110.987 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.79 ' HB3' HD23 ' A' ' 15' ' ' LEU . 3.7 m-20 -48.28 -62.9 1.25 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 123.77 0.669 . . . . 0.16 111.551 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.4 pp -75.08 -24.48 58.16 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.173 -0.611 . . . . 1.0800000000000001 112.294 -173.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.469 ' N ' HD11 ' A' ' 30' ' ' LEU . 10.1 mm100 -64.98 -32.64 74.47 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 122.057 0.932 . . . . 2.8999999999999999 109.399 174.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.75 ' HA ' ' NH1' ' A' ' 46' ' ' ARG . . . -70.84 -38.19 73.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.314 -1.312 . . . . 0.97999999999999998 107.835 177.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.888 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.0 OUTLIER -73.47 -21.8 60.33 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.719 -1.128 . . . . 1.04 111.596 176.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.675 HG13 ' O ' ' A' ' 30' ' ' LEU . 12.0 mt -68.29 -49.65 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 N-CA-C 109.801 -0.444 . . . . 1.1299999999999999 109.801 176.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.509 ' HB3' ' NH1' ' A' ' 46' ' ' ARG . . . -76.66 -14.23 59.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.939 -0.573 . . . . 0.97999999999999998 112.069 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.824 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 70.7 p -104.55 -18.25 14.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.757 -0.377 . . . . 1.0 111.694 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.16 35.04 87.95 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.51 -0.314 . . . . 0.28999999999999998 113.372 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.1 10.47 36.67 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.325 -0.941 . . . . 0.37 111.364 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.824 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.2 t0 -94.09 87.14 5.2 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.241 -1.763 . . . . 0.64000000000000001 106.241 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.756 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.74 -24.18 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 CA-C-N 114.644 -1.162 . . . . 1.27 111.058 -170.403 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -63.56 -52.2 62.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.716 -0.846 . . . . 1.29 108.716 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.72 -32.49 71.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.044 -0.98 . . . . 1.02 110.483 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -51.71 -51.71 53.93 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.573 0.225 . . . . 1.04 110.722 172.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.756 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.3 mt -61.32 -47.26 94.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 109.844 -0.428 . . . . 1.1200000000000001 109.844 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.8 -20.67 65.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.414 . . . . 2.3500000000000001 111.386 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.75 ' NH1' ' HA ' ' A' ' 32' ' ' ALA . 42.8 mtp180 -80.17 -34.67 37.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.883 0.373 . . . . 3.1699999999999999 110.549 174.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.0 -35.87 66.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.32 0.581 . . . . 1.0800000000000001 110.416 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 11.9 mt -82.13 -38.75 24.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.68 -0.691 . . . . 2.29 109.816 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -89.25 -46.54 4.37 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.038 -0.983 . . . . 1.5700000000000001 112.86 -173.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -97.18 77.95 2.72 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.347 0.594 . . . . 4.4400000000000004 110.63 -177.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -123.29 85.47 2.42 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.934 -1.135 . . . . 5.6500000000000004 107.934 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -92.17 91.01 7.56 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.442 -1.254 . . . . 9.0 110.58 -171.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 m . . . . . 0 C--O 1.246 0.914 0 CA-C-N 114.993 -1.003 . . . . 10.039999999999999 109.671 179.234 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.83 0 N-CA-C 111.958 -0.457 . . . . 7.0899999999999999 111.958 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -68.57 166.06 27.13 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.909 2.406 . . . . 7.1900000000000004 111.628 175.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 3' ' ' LEU . 2.0 pt? -67.39 100.36 0.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.488 0.661 . . . . 4.9299999999999997 110.935 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.11 -137.85 32.18 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 114.88 -1.055 . . . . 1.8799999999999999 112.755 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.0 m -113.89 53.55 0.78 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.437 0.637 . . . . 1.78 109.98 177.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.673 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 11.5 ptm -143.43 41.27 0.35 Allowed Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.809 -0.632 . . . . 2.4100000000000001 111.914 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.673 ' HD3' ' N ' ' A' ' 6' ' ' MET . 4.9 Cg_endo -87.48 14.95 2.26 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.521 2.147 . . . . 1.0600000000000001 112.966 -175.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 12' ' ' GLN . 38.3 mt-10 -135.56 -15.08 1.89 Allowed 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.233 -0.654 . . . . 1.22 109.233 165.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.486 ' HB ' ' HB2' ' A' ' 6' ' ' MET . 59.2 t -62.48 -31.24 51.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.409 -0.814 . . . . 1.26 109.315 171.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 -101.53 -50.26 3.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.229 0.538 . . . . 3.21 110.069 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.773 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.8 m-85 -61.48 -54.79 38.66 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.744 -0.662 . . . . 0.91000000000000003 111.845 -172.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.605 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 32.2 tt0 -59.72 -40.84 89.33 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.529 0.204 . . . . 1.9199999999999999 111.197 -170.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -62.04 -48.0 82.21 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.499 0.666 . . . . 1.1899999999999999 110.009 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.697 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.7 OUTLIER -66.45 -26.25 67.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.154 -0.93 . . . . 1.24 111.008 177.044 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.901 HD12 ' HB3' ' A' ' 30' ' ' LEU . 36.6 mt -73.35 -35.17 65.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 1.05 111.313 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 27.3 mt-10 -73.03 -27.15 61.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.558 0.694 . . . . 0.88 109.567 174.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.481 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.2 tt0 -65.09 -52.77 53.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.209 -0.905 . . . . 0.37 109.931 173.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.677 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 73.1 mt -62.49 -38.25 89.14 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.837 0.827 . . . . 1.02 108.982 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.3 t30 -49.87 -36.65 27.93 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.927 -1.488 . . . . 0.29999999999999999 110.575 176.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 t -86.36 -19.3 29.97 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.949 -1.023 . . . . 1.29 110.227 -177.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.677 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 24.6 mmm -73.99 -19.97 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.122 -0.945 . . . . 2.0699999999999998 110.016 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.24 15.63 15.44 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 110.57 -1.012 . . . . 0.20000000000000001 110.57 -172.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 65.8 m-85 -113.65 107.2 15.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.075 0.464 . . . . 0.45000000000000001 110.206 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.478 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -124.84 8.9 4.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.898 -0.592 . . . . 1.0800000000000001 110.847 -174.821 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.532 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -76.12 79.68 2.94 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.242 -1.392 . . . . 2.52 107.242 172.143 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.726 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -46.73 -45.83 19.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 123.66 0.6 . . . . 2.0600000000000001 111.193 -173.235 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 31' ' ' GLN . 2.3 mp0 -55.68 -46.98 77.48 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.858 0.724 . . . . 2.4399999999999999 110.442 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -70.39 -44.32 68.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.338 -0.392 . . . . 1.1100000000000001 110.269 -179.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.641 ' HB3' HD21 ' A' ' 15' ' ' LEU . 6.2 m-20 -54.0 -64.16 0.92 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.551 -0.75 . . . . 0.16 111.089 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.901 ' HB3' HD12 ' A' ' 15' ' ' LEU . 0.9 OUTLIER -73.56 -25.32 60.32 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.287 -0.565 . . . . 1.0800000000000001 111.794 -172.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -66.76 -28.56 68.5 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 118.542 0.61 . . . . 2.8999999999999999 110.109 175.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.84 -32.9 62.05 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.928 -1.138 . . . . 0.97999999999999998 107.928 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.627 HD22 ' HA ' ' A' ' 11' ' ' PHE . 2.1 mp -76.82 -20.52 56.26 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.82 -1.082 . . . . 1.04 111.286 174.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.756 HG13 ' O ' ' A' ' 30' ' ' LEU . 23.9 mt -73.89 -38.99 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.129 -0.693 . . . . 1.1299999999999999 109.129 176.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.81 -21.34 47.88 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.26 -0.882 . . . . 0.97999999999999998 111.471 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.492 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 43.6 p -103.78 -18.74 14.55 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.922 0.391 . . . . 1.0 111.808 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.18 29.96 68.01 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.28999999999999998 113.67 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.74 20.84 10.26 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.085 -1.055 . . . . 0.37 111.969 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.492 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 10.7 t0 -104.1 89.63 3.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.837 -1.542 . . . . 0.64000000000000001 106.837 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.794 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.23 -26.14 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 114.414 -1.267 . . . . 1.27 111.597 -168.835 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -50.02 71.49 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.668 -0.864 . . . . 1.29 108.668 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.09 -33.06 73.83 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.098 -0.956 . . . . 1.02 110.55 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.45 -49.27 67.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.676 -0.238 . . . . 1.04 111.017 172.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -65.01 -39.92 87.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 N-CA-C 109.919 -0.4 . . . . 1.1200000000000001 109.919 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.0 -24.43 67.03 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.007 -0.542 . . . . 2.3500000000000001 110.858 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 52.7 mtt180 -83.05 -33.37 26.46 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.862 -0.335 . . . . 3.1699999999999999 110.855 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.35 -38.32 78.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.916 0.389 . . . . 1.0800000000000001 111.144 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.491 HD22 HG21 ' A' ' 44' ' ' ILE . 3.5 mm? -88.86 -37.67 15.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.027 0.442 . . . . 2.29 110.707 176.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.17 -46.29 7.08 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.59 -0.814 . . . . 1.5700000000000001 113.282 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.7 m -97.11 77.11 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.02 0.438 . . . . 4.4400000000000004 110.501 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -111.25 85.13 2.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 122.094 0.949 . . . . 5.6500000000000004 109.01 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -108.96 81.87 1.51 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.874 -1.057 . . . . 9.0 109.946 -175.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-N 115.037 -0.983 . . . . 10.039999999999999 110.576 -178.643 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 111.643 -0.583 . . . . 7.0899999999999999 111.643 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.24 159.13 36.47 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.874 2.382 . . . . 7.1900000000000004 111.72 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.7 mt -98.06 117.01 31.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.063 0.459 . . . . 4.9299999999999997 111.233 -177.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.43 -11.94 65.69 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.668 -0.696 . . . . 1.8799999999999999 111.438 172.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 m -88.07 48.44 1.64 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.798 0.809 . . . . 1.78 109.273 175.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 43.9 mtm -145.63 63.93 9.97 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 107.379 -1.341 . . . . 2.4100000000000001 107.379 173.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -52.68 -38.71 77.04 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 123.253 2.635 . . . . 1.0600000000000001 113.742 -168.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 26.8 mt-10 -85.97 3.9 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.527 -0.469 . . . . 1.22 112.157 -174.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.8 t -81.89 -25.41 9.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.968 -0.753 . . . . 1.26 108.968 170.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -100.78 -54.49 2.81 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.763 0.792 . . . . 3.21 109.13 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.648 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.5 m-30 -61.97 -55.47 29.04 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 114.81 -1.086 . . . . 0.91000000000000003 111.462 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.5 tt0 -59.8 -33.28 71.52 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.836 -0.346 . . . . 1.9199999999999999 111.642 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -62.83 -48.87 77.19 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.702 0.763 . . . . 1.1899999999999999 109.403 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.504 ' CB ' HD23 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -68.89 -21.09 64.26 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.091 -0.959 . . . . 1.24 111.022 174.926 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.769 HD22 ' HB3' ' A' ' 29' ' ' ASN . 13.6 mt -74.37 -30.78 62.12 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 110.161 -0.311 . . . . 1.05 110.161 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.624 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 31.3 mt-10 -72.31 -30.0 64.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.886 0.85 . . . . 0.88 109.324 172.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.646 ' HG2' ' HE2' ' A' ' 21' ' ' MET . 9.5 tt0 -66.44 -48.56 69.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.272 -0.876 . . . . 0.37 110.198 174.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.861 ' HG ' HD13 ' A' ' 40' ' ' ILE . 71.8 mt -68.73 -31.49 70.59 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.941 -0.763 . . . . 1.02 108.941 177.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 8.6 t30 -50.22 -37.21 34.35 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.202 -1.363 . . . . 0.29999999999999999 109.817 173.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -86.68 -4.52 59.19 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.31 -1.314 . . . . 1.29 110.67 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.772 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 30.6 mtt -96.12 -9.2 31.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.542 0.687 . . . . 2.0699999999999998 109.223 178.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.2 15.99 36.65 Favored Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.008 -0.996 . . . . 0.20000000000000001 111.369 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.428 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 34.6 m-85 -108.84 110.64 22.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.411 0.624 . . . . 0.45000000000000001 110.032 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.47 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.57 1.83 4.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 115.291 -0.868 . . . . 1.0800000000000001 111.285 -174.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.463 ' ND2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -72.05 78.05 0.93 Allowed 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.368 -1.345 . . . . 2.52 107.368 165.124 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.781 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 15.9 mmt85 -47.45 -35.3 8.36 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.964 -1.017 . . . . 2.0600000000000001 109.95 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 35.9 mt-10 -53.31 -61.99 1.94 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.033 -0.985 . . . . 2.4399999999999999 111.71 173.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.463 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . . . -70.82 -37.0 73.19 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.064 -0.254 . . . . 1.1100000000000001 110.598 -174.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.769 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.3 m-20 -49.67 -64.3 0.85 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.036 -0.529 . . . . 0.16 110.639 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.781 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.8 pp -74.74 -24.81 58.77 Favored 'General case' 0 C--O 1.212 -0.918 0 C-N-CA 119.852 -0.739 . . . . 1.0800000000000001 112.323 -173.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.476 ' N ' HD13 ' A' ' 30' ' ' LEU . 13.1 mm100 -61.25 -34.78 75.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.683 0.754 . . . . 2.8999999999999999 109.406 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.71 -33.5 64.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.503 -1.226 . . . . 0.97999999999999998 108.784 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.757 HD21 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -76.56 -20.76 56.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.326 -0.852 . . . . 1.04 110.975 175.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.729 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.4 mt -70.12 -41.25 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 109.118 -0.697 . . . . 1.1299999999999999 109.118 174.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.93 -33.48 70.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.386 -0.825 . . . . 0.97999999999999998 111.267 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.727 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 80.7 p -96.12 -18.81 19.86 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.956 0.354 . . . . 1.0 111.956 -177.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.68 33.02 56.59 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.28999999999999998 112.717 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.757 ' HA2' HD21 ' A' ' 33' ' ' LEU . . . 95.45 10.8 56.59 Favored Glycine 0 CA--C 1.499 -0.951 0 C-N-CA 120.476 -0.869 . . . . 0.37 111.229 176.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.727 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.8 t70 -87.66 88.66 7.73 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 106.43 -1.693 . . . . 0.64000000000000001 106.43 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.861 HD13 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -70.86 -22.4 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.025 -0.989 . . . . 1.27 111.738 -166.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.99 -51.41 66.94 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.611 -0.885 . . . . 1.29 108.611 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -65.8 -34.1 77.38 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.725 -1.125 . . . . 1.02 109.95 177.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.86 79.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.266 -0.424 . . . . 1.04 111.496 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.83 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.0 mt -62.9 -45.77 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 N-CA-C 109.96 -0.385 . . . . 1.1200000000000001 109.96 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 42' ' ' ALA . 9.3 pt-20 -69.26 -19.41 63.92 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.495 -0.482 . . . . 2.3500000000000001 110.593 -177.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 48.0 mtt180 -78.17 -35.8 48.31 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 120.58 -0.448 . . . . 3.1699999999999999 109.981 173.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.81 -50.31 67.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.292 -0.413 . . . . 1.0800000000000001 110.71 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.35 -38.23 50.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.229 -0.441 . . . . 2.29 110.688 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.27 -51.3 7.57 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.747 -0.74 . . . . 1.5700000000000001 112.872 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.9 m -119.27 70.31 0.84 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.086 0.47 . . . . 4.4400000000000004 110.151 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -79.84 84.9 5.56 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.231 -1.026 . . . . 5.6500000000000004 108.231 172.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -106.11 83.66 1.93 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.925 -1.034 . . . . 9.0 110.883 -170.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 0.993 0 CA-C-N 115.156 -0.929 . . . . 10.039999999999999 109.59 178.35 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 N-CA-C 111.694 -0.563 . . . . 7.0899999999999999 111.694 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.74 112.34 2.63 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.728 2.285 . . . . 7.1900000000000004 111.929 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.446 HD21 ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -60.55 110.4 1.27 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.831 0.824 . . . . 4.9299999999999997 111.458 178.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.38 -34.25 4.4 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.383 -0.826 . . . . 1.8799999999999999 112.616 176.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 64.4 m -85.58 52.35 2.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.484 0.659 . . . . 1.78 110.591 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.667 ' HE3' HG13 ' A' ' 9' ' ' VAL . 14.3 ptm -151.35 56.32 1.94 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-N 115.356 -0.838 . . . . 2.4100000000000001 109.112 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 6' ' ' MET . 16.3 Cg_exo -68.14 -43.03 5.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.942 2.428 . . . . 1.0600000000000001 112.056 -170.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.734 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 40.9 tt0 -70.28 -20.03 63.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 1.22 110.057 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.667 HG13 ' HE3' ' A' ' 6' ' ' MET . 70.9 t -65.4 -32.25 57.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.896 -0.593 . . . . 1.26 110.161 174.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -90.16 -39.14 13.02 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.723 -0.843 . . . . 3.21 108.723 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.734 ' HB2' ' HA ' ' A' ' 8' ' ' GLU . 9.7 m-30 -61.2 -50.74 71.88 Favored 'General case' 0 C--O 1.214 -0.801 0 CA-C-N 114.515 -1.22 . . . . 0.91000000000000003 109.92 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.0 tt0 -56.01 -39.46 71.95 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 123.207 0.317 . . . . 1.9199999999999999 111.389 -177.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -63.37 -44.86 93.58 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.671 0.748 . . . . 1.1899999999999999 109.502 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.629 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.0 OUTLIER -73.66 -19.28 60.88 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.189 -0.914 . . . . 1.24 111.216 175.166 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.934 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.6 mt -77.88 -36.24 49.94 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 110.04 -0.355 . . . . 1.05 110.04 -178.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.585 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 29.0 mt-10 -70.79 -29.02 65.1 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.77 0.669 . . . . 0.88 109.64 172.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -66.28 -51.7 54.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.37 110.045 174.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.836 ' HG ' HD13 ' A' ' 40' ' ' ILE . 79.5 mt -63.61 -34.74 78.5 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.938 0.875 . . . . 1.02 108.885 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.621 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.2 t30 -53.19 -34.87 58.81 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.902 -1.499 . . . . 0.29999999999999999 110.266 175.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.4 t -86.8 -12.01 49.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.625 -1.17 . . . . 1.29 110.01 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.613 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.9 mmm -90.86 -5.55 55.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.266 -0.879 . . . . 2.0699999999999998 109.892 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.17 15.99 39.61 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.323 -0.853 . . . . 0.20000000000000001 111.195 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.449 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.4 m-85 -111.42 107.41 16.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.135 0.493 . . . . 0.45000000000000001 109.771 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.472 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -127.29 8.44 3.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.802 -0.635 . . . . 1.0800000000000001 111.322 -173.622 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -82.96 85.7 7.1 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 106.423 -1.695 . . . . 2.52 106.423 170.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.828 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.2 mmp_? -42.81 -47.52 5.53 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.069 0.856 . . . . 2.0600000000000001 110.555 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -44.39 -57.1 3.73 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.587 1.18 . . . . 2.4399999999999999 111.275 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.09 64.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.888 0.375 . . . . 1.1100000000000001 110.347 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.759 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.7 -65.03 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.162 -0.926 . . . . 0.16 111.556 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.934 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.7 pp -73.15 -28.11 62.05 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 119.126 -0.464 . . . . 1.0800000000000001 111.969 -172.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.564 ' N ' HD11 ' A' ' 30' ' ' LEU . 18.5 mt-30 -60.09 -37.02 78.71 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.731 0.776 . . . . 2.8999999999999999 109.678 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.426 ' HB3' ' HA ' ' A' ' 43' ' ' ALA . . . -72.17 -31.67 66.14 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.363 -1.29 . . . . 0.97999999999999998 108.814 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.733 HD22 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -79.33 -19.59 49.98 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.218 -0.901 . . . . 1.04 111.17 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.1 mt -71.09 -44.18 75.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.777 -0.823 . . . . 1.1299999999999999 108.777 173.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.97 -27.21 66.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.202 -0.908 . . . . 0.97999999999999998 111.287 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.814 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 54.7 p -101.73 -19.38 15.4 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.53 0.567 . . . . 1.0 112.53 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.52 26.12 72.53 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.06 -0.59 . . . . 0.28999999999999998 112.201 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.733 ' HA2' HD22 ' A' ' 33' ' ' LEU . . . 98.44 18.76 25.07 Favored Glycine 0 CA--C 1.5 -0.855 0 C-N-CA 120.66 -0.781 . . . . 0.37 111.472 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.814 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 18.4 t70 -94.04 87.87 5.48 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.395 -1.705 . . . . 0.64000000000000001 106.395 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.836 HD13 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -68.94 -23.92 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 114.849 -1.068 . . . . 1.27 110.923 -166.735 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 60.3 m-20 -52.51 -57.39 10.07 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.25 0.548 . . . . 1.29 109.717 173.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.441 ' HB1' ' CG2' ' A' ' 36' ' ' THR . . . -72.55 -22.32 61.03 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.319 -0.855 . . . . 1.02 111.09 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 32' ' ' ALA . . . -58.23 -48.63 79.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 121.162 -0.215 . . . . 1.04 110.585 168.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.436 HD13 ' CE ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -70.74 -32.98 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 120.544 -0.462 . . . . 1.1200000000000001 110.753 177.873 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 6.9 mm-40 -61.61 -22.72 65.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.087 0.47 . . . . 2.3500000000000001 110.098 174.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -88.76 -44.59 10.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.954 -0.566 . . . . 3.1699999999999999 111.195 175.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt -62.66 -37.84 87.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.855 0.359 . . . . 1.0800000000000001 111.678 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.03 -35.89 11.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.129 -0.487 . . . . 2.29 111.149 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.46 -45.87 5.69 Favored Glycine 0 CA--C 1.51 -0.261 0 C-N-CA 120.39 -0.91 . . . . 1.5700000000000001 112.494 -174.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.2 m -95.56 75.33 3.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.424 0.631 . . . . 4.4400000000000004 110.086 -178.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -106.89 85.14 2.09 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 121.949 0.88 . . . . 5.6500000000000004 108.67 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.6 81.57 1.92 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.873 -1.058 . . . . 9.0 110.541 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.001 -0.999 . . . . 10.039999999999999 108.974 175.924 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.68 0 N-CA-C 111.589 -0.604 . . . . 7.0899999999999999 111.589 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.74 146.13 26.37 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.786 2.324 . . . . 7.1900000000000004 111.04 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 3' ' ' LEU . 1.4 pt? -121.25 112.54 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.363 0.601 . . . . 4.9299999999999997 110.664 -178.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.54 4.56 72.75 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.284 -0.871 . . . . 1.8799999999999999 111.841 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.8 m -85.73 47.35 1.43 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 122.119 0.962 . . . . 1.78 109.447 178.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.409 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 33.0 mtm -146.26 59.23 5.23 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 106.848 -1.538 . . . . 2.4100000000000001 106.848 173.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.54 -38.97 90.27 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.95 2.433 . . . . 1.0600000000000001 112.766 -166.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.936 ' HG2' ' HB2' ' A' ' 12' ' ' GLN . 4.7 tt0 -82.06 -9.0 59.69 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.651 -0.42 . . . . 1.22 110.97 -172.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 87.9 t -69.43 -29.66 42.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.424 0.63 . . . . 1.26 109.512 174.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -92.83 -49.51 6.02 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.76 -0.83 . . . . 3.21 108.76 173.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.751 ' HA ' HD23 ' A' ' 33' ' ' LEU . 17.7 m-30 -62.55 -55.28 28.78 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 114.937 -1.029 . . . . 0.91000000000000003 111.968 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.936 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 50.8 tt0 -56.97 -42.43 80.16 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.778 0.288 . . . . 1.9199999999999999 111.778 -172.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.408 ' HA ' ' NE2' ' A' ' 13' ' ' GLN . 20.0 mm-40 -60.17 -45.75 92.01 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.649 0.737 . . . . 1.1899999999999999 110.181 178.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.688 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -72.77 -21.0 61.07 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.892 -1.049 . . . . 1.24 111.444 176.348 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.757 HD22 ' HB3' ' A' ' 29' ' ' ASN . 11.8 mt -73.73 -37.6 65.06 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.267 -0.271 . . . . 1.05 110.267 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 29.8 mt-10 -69.68 -28.7 66.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.721 0.772 . . . . 0.88 109.376 174.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' A' ' 21' ' ' MET . 9.1 tt0 -67.51 -46.33 73.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.407 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 42.6 mt -67.56 -31.9 72.29 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.082 0.944 . . . . 1.02 108.914 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.3 t30 -57.07 -30.5 64.34 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 113.633 -1.621 . . . . 0.29999999999999999 109.966 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -83.11 -19.8 36.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.478 -1.237 . . . . 1.29 109.9 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.531 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 13.3 mmt -80.18 -17.55 52.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.135 -0.939 . . . . 2.0699999999999998 109.889 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.25 13.45 28.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.391 -1.083 . . . . 0.20000000000000001 110.391 -171.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -105.14 108.89 20.65 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.298 0.57 . . . . 0.45000000000000001 110.856 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.563 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -125.33 13.02 4.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.627 -0.715 . . . . 1.0800000000000001 111.367 -174.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 3.2 t30 -84.99 80.25 9.36 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 106.736 -1.579 . . . . 2.52 106.736 173.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.756 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.1 mmp_? -43.18 -49.23 6.53 Favored 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.934 0.771 . . . . 2.0600000000000001 111.322 -174.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -47.73 -55.93 8.46 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 124.602 1.189 . . . . 2.4399999999999999 110.537 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -66.75 -46.91 73.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.144 -0.48 . . . . 1.1100000000000001 110.744 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.757 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.05 -64.23 0.85 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.641 -0.709 . . . . 0.16 111.31 177.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.6 pp -71.84 -27.31 62.81 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 120.376 -0.53 . . . . 1.0800000000000001 111.976 -174.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.5 ' N ' HD13 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.03 -30.85 71.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.348 0.594 . . . . 2.8999999999999999 109.93 176.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.88 -32.89 61.98 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.574 -0.899 . . . . 0.97999999999999998 108.574 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.751 HD23 ' HA ' ' A' ' 11' ' ' PHE . 1.9 mp -73.95 -23.7 59.54 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.21 -0.905 . . . . 1.04 111.334 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.4 mt -72.18 -37.55 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.278 -0.638 . . . . 1.1299999999999999 109.278 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.8 -27.5 60.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.723 -0.671 . . . . 0.97999999999999998 111.305 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.65 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 66.0 p -99.95 -17.96 17.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.696 -177.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.99 29.77 70.5 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.28999999999999998 113.056 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.03 22.0 10.44 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 119.979 -1.105 . . . . 0.37 111.48 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.65 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t0 -104.51 89.09 3.11 Favored 'General case' 0 CA--C 1.499 -1.011 0 N-CA-C 106.597 -1.631 . . . . 0.64000000000000001 106.597 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.684 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -66.95 -25.14 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 CA-C-N 114.374 -1.285 . . . . 1.27 111.599 -168.316 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.18 -49.34 74.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.579 -0.897 . . . . 1.29 108.579 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.612 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -67.95 -33.43 74.64 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.851 -1.068 . . . . 1.02 110.077 177.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.49 67.65 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 111.376 0.139 . . . . 1.04 111.376 173.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -40.14 87.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 CA-C-O 120.744 0.306 . . . . 1.1200000000000001 110.226 178.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -67.9 -19.62 65.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.233 -0.44 . . . . 2.3500000000000001 110.585 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 57.3 mtp85 -77.79 -47.73 18.24 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.158 -0.617 . . . . 3.1699999999999999 109.597 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.3 mt -70.07 -44.82 68.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.272 -0.876 . . . . 1.0800000000000001 111.485 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.35 18.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.313 -0.858 . . . . 2.29 110.369 -172.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -79.23 -57.17 3.24 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.248 -0.977 . . . . 1.5700000000000001 111.983 -176.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.1 m -86.62 80.51 8.56 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.379 0.609 . . . . 4.4400000000000004 109.42 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -110.93 84.8 1.99 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 122.25 1.024 . . . . 5.6500000000000004 108.941 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 mp -106.47 85.86 2.25 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 114.817 -1.083 . . . . 9.0 110.108 -173.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.118 -0.944 . . . . 10.039999999999999 109.476 178.436 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 111.887 -0.485 . . . . 7.0899999999999999 111.887 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.8 156.39 66.16 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.133 2.556 . . . . 7.1900000000000004 112.287 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 pp -120.58 126.6 50.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.076 -0.511 . . . . 4.9299999999999997 110.367 178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.43 -33.83 2.04 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.687 -0.688 . . . . 1.8799999999999999 113.245 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.8 m -80.0 55.28 2.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.637 0.732 . . . . 1.78 110.435 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.635 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 1.1 ppp? -153.32 46.22 0.32 Allowed Pre-proline 0 N--CA 1.439 -1.014 0 CA-C-N 114.894 -1.048 . . . . 2.4100000000000001 108.874 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.635 ' HD3' ' N ' ' A' ' 6' ' ' MET . 16.0 Cg_exo -65.68 -47.47 3.95 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 122.15 1.9 . . . . 1.0600000000000001 111.503 -171.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.679 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 20.7 mt-10 -73.69 -12.89 60.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.942 -0.572 . . . . 1.22 111.229 -178.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.49 ' HB ' ' O ' ' A' ' 6' ' ' MET . 87.1 t -63.08 -27.27 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.986 -0.746 . . . . 1.26 108.986 170.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -102.4 -47.94 4.32 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.663 0.744 . . . . 3.21 110.001 172.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.679 ' HB2' ' HA ' ' A' ' 8' ' ' GLU . 12.5 m-30 -62.39 -54.91 33.43 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 115.005 -0.998 . . . . 0.91000000000000003 112.204 -174.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 8.8 tt0 -58.84 -36.87 75.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.197 -0.201 . . . . 1.9199999999999999 111.049 -173.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -64.18 -41.46 97.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.813 0.816 . . . . 1.1899999999999999 109.937 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.772 ' HB3' HG13 ' A' ' 40' ' ' ILE . 33.4 mt-30 -74.98 -21.12 59.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.118 -0.946 . . . . 1.24 110.931 175.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.876 HD12 ' HB3' ' A' ' 30' ' ' LEU . 20.1 mt -75.46 -36.67 60.65 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.591 -0.277 . . . . 1.05 110.317 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.6 mt-10 -73.43 -26.02 60.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.499 0.666 . . . . 0.88 109.975 174.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.97 -50.87 60.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.267 -0.878 . . . . 0.37 109.723 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.843 ' HG ' HD11 ' A' ' 40' ' ' ILE . 33.0 mt -63.37 -34.71 78.31 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.9 0.857 . . . . 1.02 109.135 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.4 t30 -53.92 -34.93 60.99 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.031 -1.441 . . . . 0.29999999999999999 110.275 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 t -87.23 -6.2 58.66 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.558 -1.201 . . . . 1.29 109.822 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.56 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 7.2 mmm -98.33 -4.72 34.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.966 -1.016 . . . . 2.0699999999999998 109.864 -178.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.69 18.23 33.24 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.3 -0.864 . . . . 0.20000000000000001 111.295 -177.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.456 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 60.8 m-85 -113.4 109.32 18.5 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.116 0.484 . . . . 0.45000000000000001 109.764 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.532 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -126.98 0.88 3.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.054 -0.521 . . . . 1.0800000000000001 111.596 -172.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.69 82.31 3.32 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.117 -1.438 . . . . 2.52 107.117 171.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.785 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.5 mmp_? -41.64 -49.0 4.19 Favored 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 124.011 0.819 . . . . 2.0600000000000001 110.933 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 2.4 mm-40 -43.59 -58.57 2.58 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.729 1.268 . . . . 2.4399999999999999 110.588 176.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.83 -49.23 63.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 1.1100000000000001 110.723 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.752 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.1 m-20 -45.55 -64.25 0.77 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.745 0.653 . . . . 0.16 111.385 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.876 ' HB3' HD12 ' A' ' 15' ' ' LEU . 2.1 pp -72.99 -27.01 61.55 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-O 119.006 -0.521 . . . . 1.0800000000000001 112.189 -173.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.502 ' N ' HD13 ' A' ' 30' ' ' LEU . 23.6 mm-40 -60.78 -35.33 76.16 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.711 0.767 . . . . 2.8999999999999999 109.389 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -73.12 -33.16 65.38 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.563 -1.199 . . . . 0.97999999999999998 108.718 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.61 HD21 ' CB ' ' A' ' 14' ' ' GLN . 2.3 mp -75.84 -25.61 56.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.164 -0.926 . . . . 1.04 111.387 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 30' ' ' LEU . 5.3 mt -73.99 -32.71 34.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.394 0.616 . . . . 1.1299999999999999 109.391 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.61 ' HB2' ' NH1' ' A' ' 46' ' ' ARG . . . -79.55 -23.54 42.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.455 -0.793 . . . . 0.97999999999999998 111.139 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.43 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 45.7 p -104.79 -17.98 14.41 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.214 0.45 . . . . 1.0 112.214 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.72 32.21 70.61 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 121.408 -0.425 . . . . 0.28999999999999998 113.051 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.93 37.88 5.06 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 119.884 -1.15 . . . . 0.37 111.43 176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.43 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t70 -119.38 87.11 2.68 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 106.119 -1.808 . . . . 0.64000000000000001 106.119 172.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.866 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -65.55 -24.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.557 0 CA-C-N 113.836 -1.529 . . . . 1.27 111.644 -166.597 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -62.03 -50.44 72.01 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.938 -0.764 . . . . 1.29 108.938 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.573 ' O ' ' HG3' ' A' ' 45' ' ' GLU . . . -68.88 -32.13 71.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.876 -1.056 . . . . 1.02 110.367 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -56.14 -49.85 72.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 121.26 -0.176 . . . . 1.04 110.882 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.866 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.6 mt -63.29 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.699 0.285 . . . . 1.1200000000000001 110.812 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -72.99 -19.6 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.745 -0.382 . . . . 2.3500000000000001 110.585 -176.3 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.61 ' NH1' ' HB2' ' A' ' 35' ' ' ALA . 75.3 mtt180 -84.85 -27.11 26.95 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.974 0.416 . . . . 3.1699999999999999 110.409 173.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 96.2 mt -70.14 -44.22 69.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 1.0800000000000001 110.071 174.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.45 -35.86 80.04 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.315 -0.857 . . . . 2.29 109.318 170.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.83 71.96 0.96 Allowed Glycine 0 CA--C 1.496 -1.11 0 N-CA-C 110.603 -0.999 . . . . 1.5700000000000001 110.603 -177.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.1 m -32.53 100.34 0.02 OUTLIER 'General case' 0 C--O 1.233 0.186 0 O-C-N 125.11 1.124 . . . . 4.4400000000000004 112.403 -177.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -110.98 89.55 3.08 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.661 -1.154 . . . . 5.6500000000000004 108.971 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.25 92.32 3.72 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.243 -0.89 . . . . 9.0 110.627 -174.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.254 1.335 0 CA-C-N 113.944 -1.48 . . . . 10.039999999999999 110.286 177.14 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.943 -0.463 . . . . 7.0899999999999999 111.943 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -79.16 160.44 26.54 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 7.1900000000000004 111.772 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.2 mt -76.94 100.29 5.53 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.996 -0.547 . . . . 4.9299999999999997 111.207 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.69 -2.56 22.54 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.697 -0.763 . . . . 1.8799999999999999 111.45 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.7 m -84.67 50.81 1.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.717 0.77 . . . . 1.78 110.062 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.5 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 25.2 mtm -145.75 56.59 3.51 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.176 -0.92 . . . . 2.4100000000000001 108.894 177.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 6' ' ' MET . 34.9 Cg_exo -60.13 -36.83 87.45 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.251 1.968 . . . . 1.0600000000000001 112.229 -170.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 29.8 mt-10 -82.99 -11.53 58.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.22 111.315 -176.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.5 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 98.4 t -75.3 -21.03 16.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.654 0.74 . . . . 1.26 109.422 174.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -102.78 -55.81 2.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.581 0.705 . . . . 3.21 109.156 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.777 ' HA ' HD23 ' A' ' 33' ' ' LEU . 19.2 m-30 -61.54 -54.6 40.93 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.849 -1.069 . . . . 0.91000000000000003 111.375 -172.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.618 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.9 tt0 -59.54 -34.34 72.52 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 121.235 -0.186 . . . . 1.9199999999999999 111.492 -172.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.02 -47.42 77.5 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.578 0.704 . . . . 1.1899999999999999 109.427 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.716 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.1 mp0 -69.6 -19.28 63.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.282 -0.872 . . . . 1.24 111.203 174.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.669 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.5 mt -73.75 -40.2 63.67 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.621 -0.511 . . . . 1.05 109.621 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 33.3 mt-10 -64.54 -31.35 72.53 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.827 0.822 . . . . 0.88 109.59 173.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.504 ' NE2' HG21 ' A' ' 40' ' ' ILE . 8.1 tt0 -66.83 -50.63 61.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.096 -0.956 . . . . 0.37 111.056 175.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.667 HD23 HG12 ' A' ' 44' ' ' ILE . 62.0 mt -66.37 -30.15 70.47 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.854 0.835 . . . . 1.02 108.871 177.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.615 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.9 t30 -54.23 -35.29 62.3 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.051 -1.431 . . . . 0.29999999999999999 110.3 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 t -87.1 -3.74 59.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.727 -1.124 . . . . 1.29 110.027 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.729 ' HE2' HD13 ' A' ' 44' ' ' ILE . 31.6 mmm -97.48 -8.38 29.38 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.306 -0.861 . . . . 2.0699999999999998 109.718 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.28 16.89 33.39 Favored Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.27 -0.877 . . . . 0.20000000000000001 111.153 -176.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.471 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.3 m-85 -110.63 109.52 19.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.45000000000000001 109.879 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.76 -8.06 10.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.764 -0.653 . . . . 1.0800000000000001 111.43 -172.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -73.13 83.14 1.3 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.94 -1.504 . . . . 2.52 106.94 169.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.873 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 57.2 mtt85 -60.98 -26.01 67.26 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.218 -0.446 . . . . 2.0600000000000001 110.717 -175.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -52.76 -50.5 63.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.433 -0.58 . . . . 2.4399999999999999 109.433 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.52 -46.26 60.14 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.987 -0.551 . . . . 1.1100000000000001 110.421 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.558 ' CB ' HD22 ' A' ' 15' ' ' LEU . 6.6 m-20 -50.82 -60.41 3.09 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.659 -0.701 . . . . 0.16 111.268 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.873 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 2.0 pp -73.87 -24.22 59.71 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 120.294 -0.563 . . . . 1.0800000000000001 112.343 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.552 ' N ' HD11 ' A' ' 30' ' ' LEU . 17.4 mm-40 -60.85 -34.66 74.93 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.88 0.848 . . . . 2.8999999999999999 109.328 172.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -31.17 61.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.285 -1.325 . . . . 0.97999999999999998 108.176 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 11' ' ' PHE . 0.9 OUTLIER -79.68 -22.06 43.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.166 -0.925 . . . . 1.04 111.233 177.289 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.727 HG13 ' O ' ' A' ' 30' ' ' LEU . 6.0 mt -73.33 -38.5 53.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.641 -0.503 . . . . 1.1299999999999999 109.641 175.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.6 -22.16 54.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.852 -0.613 . . . . 0.97999999999999998 111.152 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.466 ' OG1' ' HA ' ' A' ' 33' ' ' LEU . 46.4 p -102.86 -18.78 14.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.338 0.496 . . . . 1.0 112.338 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.93 28.86 59.94 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 121.343 -0.456 . . . . 0.28999999999999998 113.241 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.725 ' HA2' HD22 ' A' ' 33' ' ' LEU . . . 103.07 10.17 37.54 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.103 -1.046 . . . . 0.37 111.487 176.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.458 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.3 t70 -96.52 87.88 4.53 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 107.117 -1.438 . . . . 0.64000000000000001 107.117 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.787 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -64.59 -25.72 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-N 114.11 -1.404 . . . . 1.27 111.536 -169.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 5.5 m-80 -60.51 -53.91 51.8 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.829 -0.804 . . . . 1.29 108.829 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.26 -30.9 70.04 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.437 -0.801 . . . . 1.02 110.559 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -46.32 74.0 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.395 -0.366 . . . . 1.04 110.543 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.787 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -68.13 -37.53 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.892 -0.41 . . . . 1.1200000000000001 109.892 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.481 ' HG3' ' O ' ' A' ' 41' ' ' ASN . 51.0 mt-10 -65.7 -21.12 66.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.93 -0.577 . . . . 2.3500000000000001 110.935 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 54.1 mtt180 -87.33 -40.95 14.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.312 -0.404 . . . . 3.1699999999999999 110.845 176.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -47.57 85.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.995 0.426 . . . . 1.0800000000000001 110.685 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HG23 ' A' ' 44' ' ' ILE . 4.3 mm? -72.66 -32.41 65.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.929 -0.578 . . . . 2.29 109.842 173.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 68.14 72.27 0.84 Allowed Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.737 -0.945 . . . . 1.5700000000000001 110.737 -178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.2 m -35.13 99.21 0.02 OUTLIER 'General case' 0 C--O 1.233 0.206 0 O-C-N 125.189 1.17 . . . . 4.4400000000000004 111.89 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -109.6 86.56 2.32 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.797 -1.092 . . . . 5.6500000000000004 109.249 -177.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mp -124.18 84.77 2.32 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.011 -0.995 . . . . 9.0 109.626 -176.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.481 -0.781 . . . . 10.039999999999999 110.028 -175.632 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 111.648 -0.581 . . . . 7.0899999999999999 111.648 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -78.24 126.37 7.67 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.364 2.043 . . . . 7.1900000000000004 112.779 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.656 ' O ' ' HG ' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -111.35 110.09 20.39 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.499 0.666 . . . . 4.9299999999999997 109.33 174.155 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -121.11 -16.79 4.26 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.457 -0.878 . . . . 1.8799999999999999 111.945 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 m -115.1 51.17 0.93 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.536 0.684 . . . . 1.78 110.544 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.493 ' HE2' HG12 ' A' ' 9' ' ' VAL . 73.7 mtp -138.37 56.34 10.06 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 2.4100000000000001 108.691 172.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.429 ' HD3' ' N ' ' A' ' 6' ' ' MET . 35.5 Cg_exo -60.87 -57.39 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.827 2.351 . . . . 1.0600000000000001 112.451 -168.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.706 ' HG2' ' HB2' ' A' ' 12' ' ' GLN . 21.7 tt0 -82.31 1.81 35.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.393 0.616 . . . . 1.22 110.215 -170.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.493 HG12 ' HE2' ' A' ' 6' ' ' MET . 93.3 t -78.65 -31.85 15.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.582 -0.735 . . . . 1.26 109.217 173.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -101.65 -39.85 7.27 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.682 -0.69 . . . . 3.21 110.151 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.633 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 17.2 m-30 -61.44 -54.55 42.02 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 115.238 -0.892 . . . . 0.91000000000000003 110.318 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.706 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 8.6 tt0 -55.78 -35.56 66.39 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 123.368 0.417 . . . . 1.9199999999999999 111.51 -175.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -64.56 -49.65 70.38 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.566 0.698 . . . . 1.1899999999999999 109.267 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.49 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -68.75 -19.04 64.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.147 -0.933 . . . . 1.24 111.038 174.378 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.901 HD13 ' HB3' ' A' ' 30' ' ' LEU . 11.3 mt -75.97 -35.85 59.49 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 122.027 -0.42 . . . . 1.05 110.083 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.548 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 30.7 mt-10 -71.93 -25.6 61.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.538 0.685 . . . . 0.88 109.362 173.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -70.01 -46.28 65.44 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.444 -0.798 . . . . 0.37 110.569 174.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.88 ' HG ' HD11 ' A' ' 40' ' ' ILE . 63.7 mt -69.47 -33.56 73.08 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.281 -1.007 . . . . 1.02 108.281 177.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.595 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 6.1 t30 -51.8 -35.01 42.58 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.482 -1.69 . . . . 0.29999999999999999 110.146 173.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.6 t -86.57 -11.1 52.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.592 -1.186 . . . . 1.29 110.378 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.657 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.2 mmm -90.45 -13.26 35.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.716 -0.675 . . . . 2.0699999999999998 110.204 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.02 13.32 27.49 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-N 115.386 -0.825 . . . . 0.20000000000000001 111.349 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -111.12 107.96 17.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.244 0.545 . . . . 0.45000000000000001 110.392 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.492 ' N ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -123.79 6.22 5.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.94 -0.573 . . . . 1.0800000000000001 111.37 -174.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.473 ' ND2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -75.9 79.16 2.8 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.383 -1.339 . . . . 2.52 107.383 167.437 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.773 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 9.0 mmt85 -46.36 -39.48 10.4 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.574 -0.739 . . . . 2.0600000000000001 109.926 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -46.94 -62.19 1.52 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.649 -1.16 . . . . 2.4399999999999999 111.429 172.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.473 ' HB2' ' ND2' ' A' ' 25' ' ' ASN . . . -72.77 -39.69 66.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.802 -0.359 . . . . 1.1100000000000001 110.76 -175.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.757 ' HB3' HD22 ' A' ' 15' ' ' LEU . 7.3 m-20 -49.34 -64.95 0.66 Allowed 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 123.284 0.365 . . . . 0.16 111.082 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.901 ' HB3' HD13 ' A' ' 15' ' ' LEU . 2.3 pp -74.98 -26.53 59.64 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 119.835 -0.746 . . . . 1.0800000000000001 112.364 -171.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.583 ' N ' HD11 ' A' ' 30' ' ' LEU . 23.4 mt-30 -63.65 -33.3 75.32 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.763 0.792 . . . . 2.8999999999999999 109.661 176.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.45 67.23 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.499 -1.228 . . . . 0.97999999999999998 108.541 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.717 HD22 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -74.78 -23.24 58.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.316 -0.857 . . . . 1.04 110.935 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.745 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.6 mt -70.72 -36.85 66.75 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.649 0.738 . . . . 1.1299999999999999 109.246 175.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.566 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -78.65 -20.52 50.08 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.055 -0.975 . . . . 0.97999999999999998 111.501 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.6 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 63.3 p -108.36 -19.1 13.58 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.852 -0.339 . . . . 1.0 111.817 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.8 26.46 58.54 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 121.473 -0.394 . . . . 0.28999999999999998 112.908 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.717 ' HA2' HD22 ' A' ' 33' ' ' LEU . . . 97.69 16.87 32.47 Favored Glycine 0 CA--C 1.497 -1.059 0 C-N-CA 120.2 -1.0 . . . . 0.37 111.311 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.6 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.0 t70 -93.13 93.06 8.08 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 105.405 -2.072 . . . . 0.64000000000000001 105.405 170.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.88 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.77 -25.05 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-N 114.862 -1.063 . . . . 1.27 111.355 -166.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -59.52 -52.03 67.29 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.295 -0.631 . . . . 1.29 109.295 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.591 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -69.8 -27.18 64.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.318 -0.855 . . . . 1.02 110.288 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.488 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -61.65 -49.2 77.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 1.04 110.859 173.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.825 HG13 ' O ' ' A' ' 40' ' ' ILE . 2.6 mt -65.88 -38.63 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 120.685 0.278 . . . . 1.1200000000000001 110.264 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 42' ' ' ALA . 6.4 pt-20 -66.71 -24.24 66.22 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.905 -0.318 . . . . 2.3500000000000001 110.487 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.591 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.0 mtt180 -82.17 -29.67 31.41 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.626 -0.43 . . . . 3.1699999999999999 110.091 175.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 44' ' ' ILE . 91.4 mt -66.14 -49.09 68.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.263 -0.426 . . . . 1.0800000000000001 110.808 177.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -83.47 -34.93 25.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.092 0.472 . . . . 2.29 110.679 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -72.56 -45.34 36.95 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.468 -0.787 . . . . 1.5700000000000001 113.07 -174.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.5 m -85.36 74.58 10.36 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.373 0.606 . . . . 4.4400000000000004 109.977 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -107.94 86.03 2.22 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.758 0.789 . . . . 5.6500000000000004 109.156 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -119.58 85.18 2.33 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.307 -0.86 . . . . 9.0 110.217 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.246 0.913 0 CA-C-N 114.85 -1.068 . . . . 10.039999999999999 108.918 177.863 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 N-CA-C 111.804 -0.518 . . . . 7.0899999999999999 111.804 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -63.5 166.65 14.84 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.851 2.367 . . . . 7.1900000000000004 112.366 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.421 HD23 ' SD ' ' A' ' 6' ' ' MET . 75.3 mt -81.79 98.97 8.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.996 -0.547 . . . . 4.9299999999999997 111.625 -177.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.32 -8.79 1.28 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.234 -0.893 . . . . 1.8799999999999999 111.014 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.9 m -89.76 49.83 1.79 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.811 0.815 . . . . 1.78 109.719 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.541 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 16.6 mtm -139.96 50.13 2.22 Favored Pre-proline 0 N--CA 1.448 -0.541 0 CA-C-N 114.853 -1.067 . . . . 2.4100000000000001 109.379 177.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' A' ' 6' ' ' MET . 37.8 Cg_exo -58.76 -41.72 60.42 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 121.817 1.678 . . . . 1.0600000000000001 112.038 -171.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.405 ' HB3' ' HB2' ' A' ' 12' ' ' GLN . 28.7 mt-10 -83.47 -11.57 57.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.736 -0.386 . . . . 1.22 111.373 -175.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.455 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 81.2 t -67.42 -28.61 42.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.515 0.674 . . . . 1.26 109.297 173.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 -99.11 -56.66 2.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.684 -0.689 . . . . 3.21 109.793 172.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.71 ' HA ' HD22 ' A' ' 33' ' ' LEU . 18.3 m-30 -62.36 -55.21 30.23 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.308 -0.86 . . . . 0.91000000000000003 111.679 -171.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.576 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 29.4 tt0 -58.68 -37.49 76.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 117.931 0.332 . . . . 1.9199999999999999 110.979 -171.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -59.8 -52.07 67.04 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 122.212 1.006 . . . . 1.1899999999999999 109.395 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.647 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -70.24 -20.04 63.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.182 -1.372 . . . . 1.24 111.365 178.289 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 30' ' ' LEU . 13.0 mt -74.92 -35.09 62.2 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 122.348 -0.22 . . . . 1.05 110.652 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 34.3 mt-10 -70.68 -29.84 66.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.786 0.803 . . . . 0.88 109.18 173.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.532 ' HG2' ' HE3' ' A' ' 21' ' ' MET . 9.3 tt0 -66.28 -48.14 71.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.976 -1.011 . . . . 0.37 110.489 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.853 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 67.1 mt -69.59 -31.86 70.26 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.849 -0.797 . . . . 1.02 108.849 177.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.7 t30 -50.92 -34.35 28.12 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.181 -1.372 . . . . 0.29999999999999999 110.062 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -86.71 -14.96 40.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.415 -1.266 . . . . 1.29 110.61 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.853 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 23.5 mtt -85.41 -10.76 55.78 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.488 0.661 . . . . 2.0699999999999998 109.961 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.34 10.91 43.5 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 110.808 -0.917 . . . . 0.20000000000000001 110.808 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.41 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.0 m-85 -107.73 109.32 20.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.582 0.706 . . . . 0.45000000000000001 110.625 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.455 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.53 9.8 3.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 115.554 -0.748 . . . . 1.0800000000000001 111.063 -174.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.522 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 2.3 t30 -79.34 79.8 5.76 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 106.882 -1.525 . . . . 2.52 106.882 172.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.77 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 58.7 mmt-85 -46.04 -44.46 15.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.891 0.745 . . . . 2.0600000000000001 111.948 -171.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.6 -49.98 75.67 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.514 0.508 . . . . 2.4399999999999999 110.304 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.522 ' HB2' ' HB3' ' A' ' 25' ' ' ASN . . . -64.06 -47.77 78.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.18 -0.304 . . . . 1.1100000000000001 110.18 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.74 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.5 m-20 -48.48 -63.46 1.08 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.656 -0.702 . . . . 0.16 111.036 176.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' A' ' 15' ' ' LEU . 2.2 pp -73.8 -25.46 60.13 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 120.307 -0.557 . . . . 1.0800000000000001 112.395 -172.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.566 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.6 mt-30 -64.32 -32.48 74.1 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.753 0.787 . . . . 2.8999999999999999 109.848 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.4 -33.46 64.99 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.861 -1.063 . . . . 0.97999999999999998 108.591 176.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.775 HD21 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -75.19 -24.61 57.85 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.09 -0.959 . . . . 1.04 110.991 175.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.752 HG13 ' O ' ' A' ' 30' ' ' LEU . 26.4 mt -67.75 -48.29 76.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.363 -0.606 . . . . 1.1299999999999999 109.363 175.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.4 -28.0 68.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.432 -0.804 . . . . 0.97999999999999998 111.681 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.676 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 40.2 p -98.49 -18.76 18.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.865 0.364 . . . . 1.0 111.921 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.53 21.32 60.32 Favored Glycine 0 C--N 1.322 -0.23 0 C-N-CA 121.202 -0.523 . . . . 0.28999999999999998 112.346 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.775 ' HA2' HD21 ' A' ' 33' ' ' LEU . . . 95.77 16.5 38.94 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 111.047 -0.821 . . . . 0.37 111.047 -178.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.676 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 19.7 t70 -90.89 87.73 6.75 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 106.041 -1.837 . . . . 0.64000000000000001 106.041 175.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.845 HD13 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -73.54 -27.11 22.83 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.955 -1.02 . . . . 1.27 113.02 -158.495 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 8.8 p30 -60.97 -43.25 99.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.91 -0.774 . . . . 1.29 108.91 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -72.69 -30.6 64.36 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.022 -0.99 . . . . 1.02 110.639 176.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.52 91.53 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.468 -0.333 . . . . 1.04 110.83 172.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.1 mt -65.98 -38.71 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 N-CA-C 109.356 -0.609 . . . . 1.1200000000000001 109.356 176.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 21.5 mm-40 -58.19 -30.39 66.39 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.505 -0.77 . . . . 2.3500000000000001 110.41 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.3 mtp85 -77.96 -43.73 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.687 0.28 . . . . 3.1699999999999999 110.742 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.76 -45.09 91.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 1.0800000000000001 111.493 -177.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.556 HD22 HG23 ' A' ' 44' ' ' ILE . 3.0 mm? -72.18 -35.62 69.04 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.359 -0.608 . . . . 2.29 109.359 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.641 ' O ' ' HG3' ' A' ' 51' ' ' GLN . . . 73.68 74.84 0.79 Allowed Glycine 0 CA--C 1.491 -1.459 0 N-CA-C 109.944 -1.263 . . . . 1.5700000000000001 109.944 -173.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 p -28.09 97.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 O-C-N 125.52 1.365 . . . . 4.4400000000000004 112.198 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 45.3 mt-30 -101.73 86.25 2.89 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.828 -1.078 . . . . 5.6500000000000004 108.238 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -114.75 73.74 0.84 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.056 -0.974 . . . . 9.0 110.049 -173.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.249 1.067 0 CA-C-N 114.585 -1.188 . . . . 10.039999999999999 108.806 178.055 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 111.732 -0.547 . . . . 7.0899999999999999 111.732 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -66.99 133.92 32.67 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.429 2.086 . . . . 7.1900000000000004 111.729 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.24 100.6 9.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.019 0.437 . . . . 4.9299999999999997 110.263 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.7 -12.53 78.1 Favored Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.655 -0.783 . . . . 1.8799999999999999 111.43 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.404 ' C ' ' HD3' ' A' ' 7' ' ' PRO . 4.7 p -87.94 48.68 1.68 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 122.062 0.934 . . . . 1.78 110.084 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.499 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 20.7 mtm -139.23 55.24 7.07 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 114.488 -1.233 . . . . 2.4100000000000001 108.155 173.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 6' ' ' MET . 68.1 Cg_exo -55.65 -47.25 26.41 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.529 2.152 . . . . 1.0600000000000001 112.027 -170.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -80.88 13.27 2.74 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.567 -0.453 . . . . 1.22 111.564 -174.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 92.8 t -94.67 -27.95 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.25 -0.648 . . . . 1.26 109.25 169.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -103.27 -48.45 4.0 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 122.041 0.924 . . . . 3.21 108.684 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.627 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 2.8 m-85 -60.88 -51.42 69.37 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.196 -1.366 . . . . 0.91000000000000003 110.182 -176.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.665 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 7.0 tt0 -58.24 -33.6 69.53 Favored 'General case' 0 C--O 1.222 -0.387 0 O-C-N 123.202 0.314 . . . . 1.9199999999999999 111.552 -174.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -65.3 -49.5 69.28 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.475 0.655 . . . . 1.1899999999999999 109.491 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.669 ' CB ' HD22 ' A' ' 33' ' ' LEU . 1.3 mp0 -66.97 -20.74 65.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.508 -0.769 . . . . 1.24 110.728 174.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.775 HD12 ' HB3' ' A' ' 30' ' ' LEU . 15.5 mt -78.18 -35.6 48.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.102 -0.499 . . . . 1.05 110.907 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.665 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.1 mt-10 -64.8 -34.29 78.01 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.78 0.8 . . . . 0.88 108.863 172.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.4 tt0 -63.92 -52.74 58.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.734 -1.121 . . . . 0.37 110.877 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.66 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 48.0 mt -64.67 -35.3 80.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.838 0.828 . . . . 1.02 109.128 177.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.601 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 7.6 t30 -53.95 -34.25 59.14 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.969 -1.469 . . . . 0.29999999999999999 110.371 176.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 t -87.06 -14.75 40.6 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.159 -1.382 . . . . 1.29 110.012 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.876 ' HE1' HD13 ' A' ' 44' ' ' ILE . 26.0 mmm -82.21 -17.77 44.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.007 -0.997 . . . . 2.0699999999999998 110.009 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.46 10.84 30.46 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.09 -0.959 . . . . 0.20000000000000001 110.943 -172.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -103.77 106.15 16.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.382 0.61 . . . . 0.45000000000000001 110.414 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.07 15.87 3.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.701 -0.681 . . . . 1.0800000000000001 111.469 -177.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.523 ' HB3' ' HB1' ' A' ' 28' ' ' ALA . 54.6 t30 -84.22 84.19 7.71 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.41 -1.7 . . . . 2.52 106.41 171.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.779 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mmp_? -45.85 -49.62 15.13 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 123.842 0.714 . . . . 2.0600000000000001 111.762 -172.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -53.89 -51.23 64.35 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 123.953 0.783 . . . . 2.4399999999999999 110.931 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' A' ' 25' ' ' ASN . . . -60.09 -52.66 64.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.689 0.281 . . . . 1.1100000000000001 110.293 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.748 ' HB3' HD21 ' A' ' 15' ' ' LEU . 4.6 m-20 -48.0 -64.34 0.82 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.46 -0.791 . . . . 0.16 111.568 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.7 pp -73.93 -25.04 59.76 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 120.432 -0.507 . . . . 1.0800000000000001 112.124 -172.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.458 ' N ' HD12 ' A' ' 30' ' ' LEU . 16.5 mt-30 -62.45 -35.64 79.94 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.865 0.841 . . . . 2.8999999999999999 109.295 174.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -71.98 -33.08 67.85 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.471 -1.24 . . . . 0.97999999999999998 108.49 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.669 HD22 ' CB ' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -78.01 -20.04 53.28 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.588 -1.187 . . . . 1.04 111.166 176.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.741 HG13 ' O ' ' A' ' 30' ' ' LEU . 34.6 mt -68.9 -49.08 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 109.053 -0.721 . . . . 1.1299999999999999 109.053 174.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.03 -20.66 60.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.491 -0.777 . . . . 0.97999999999999998 112.016 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.79 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 60.8 p -102.43 -18.72 15.24 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.874 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.74 26.13 74.76 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.315 -0.469 . . . . 0.28999999999999998 113.533 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.99 20.98 8.01 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.398 -0.906 . . . . 0.37 111.729 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.79 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 63.0 t0 -103.9 87.17 2.73 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 106.735 -1.579 . . . . 0.64000000000000001 106.735 176.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.651 ' HB ' ' CG ' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -65.85 -28.83 45.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-N 113.927 -1.488 . . . . 1.27 111.437 -167.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -61.43 -47.13 87.12 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.59 0.71 . . . . 1.29 109.251 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.65 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -75.25 -29.46 60.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.067 -0.97 . . . . 1.02 109.968 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.495 ' HA ' ' HB3' ' A' ' 32' ' ' ALA . . . -54.51 -45.07 73.22 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.757 0.313 . . . . 1.04 110.294 171.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.876 HD13 ' HE1' ' A' ' 21' ' ' MET . 0.9 OUTLIER -68.34 -37.85 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 109.646 -0.501 . . . . 1.1200000000000001 109.646 177.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -60.7 -20.09 60.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.892 -0.595 . . . . 2.3500000000000001 110.688 174.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.65 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 64.1 mtp85 -87.6 -42.42 12.72 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.595 -0.442 . . . . 3.1699999999999999 110.336 177.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 79.6 mt -62.72 -46.93 85.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.783 -0.644 . . . . 1.0800000000000001 110.665 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 mt -75.75 -38.12 58.68 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.601 -0.727 . . . . 2.29 109.95 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.782 ' O ' ' HG3' ' A' ' 51' ' ' GLN . . . 87.55 93.24 0.97 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 109.357 -1.497 . . . . 1.5700000000000001 109.357 -173.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m -28.89 101.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 O-C-N 125.141 1.142 . . . . 4.4400000000000004 111.995 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.782 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 44.0 mt-30 -114.24 86.89 2.51 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.958 -1.019 . . . . 5.6500000000000004 108.437 -178.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 77.11 1.02 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.668 -0.696 . . . . 9.0 109.746 -176.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.396 -0.82 . . . . 10.039999999999999 109.523 -179.082 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.578 0.704 . . . . 2.74 109.438 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.933 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.0 m-30 -62.06 -55.15 31.97 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 114.959 -1.019 . . . . 0.56 111.392 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.486 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 30.7 tt0 -62.5 -30.7 71.47 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.03 0.206 . . . . 1.26 111.195 -170.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -73.19 -44.9 59.05 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.103 -0.702 . . . . 1.19 109.103 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.665 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.2 mp0 -62.49 -24.98 67.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.387 -0.824 . . . . 1.24 109.996 171.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 29' ' ' ASN . 12.2 mt -72.47 -35.23 68.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.227 -0.442 . . . . 0.2 110.077 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.591 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 27.1 mt-10 -67.07 -34.36 77.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.85 0.833 . . . . 0.88 109.639 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 20' ' ' SER . 51.8 tt0 -66.82 -46.8 74.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.497 178.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 23' ' ' PHE . 52.4 mt -67.0 -32.5 73.78 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.918 0.866 . . . . 0.17 109.22 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.618 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.8 t30 -56.53 -28.21 59.47 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.976 -1.466 . . . . 0.25 110.524 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 17' ' ' GLN . 71.2 m -81.06 -19.56 43.49 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.92 -1.491 . . . . 0.66 110.112 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.5 mmm -98.75 3.79 47.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.18 -1.373 . . . . 1.41 110.55 -172.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.9 16.75 55.75 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.231 -0.895 . . . . 0.19 111.073 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 59.6 m-85 -108.01 104.28 13.69 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.362 0.601 . . . . 0.37 109.591 177.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.447 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -121.46 4.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.47 -0.786 . . . . 0.23 110.895 -175.854 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.474 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 18.4 t-20 -78.47 81.8 4.78 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.59 -1.633 . . . . 1.84 106.59 171.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.764 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.0 mmp_? -43.01 -48.63 6.02 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.839 0.712 . . . . 1.63 110.926 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -45.73 -57.72 4.03 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.249 0.968 . . . . 2.44 111.161 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.474 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -63.73 -49.48 72.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.524 -0.307 . . . . 0.26 110.987 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.867 ' HB3' HD22 ' A' ' 15' ' ' LEU . 3.7 m-20 -48.28 -62.9 1.25 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 123.77 0.669 . . . . 0.14 111.551 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.4 pp -75.08 -24.48 58.16 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.173 -0.611 . . . . 0.27 112.294 -173.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.47 ' N ' HD12 ' A' ' 30' ' ' LEU . 63.4 mm-40 -64.98 -32.64 74.47 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 122.057 0.932 . . . . 2.18 109.399 174.074 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.735 ' HA ' ' NH1' ' A' ' 46' ' ' ARG . . . -70.84 -38.19 73.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.314 -1.312 . . . . 0.12 107.835 177.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.0 OUTLIER -73.47 -21.8 60.33 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.719 -1.128 . . . . 0.2 111.596 176.897 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.698 HG13 ' O ' ' A' ' 30' ' ' LEU . 12.0 mt -68.29 -49.65 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 N-CA-C 109.801 -0.444 . . . . 0.34 109.801 176.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.558 ' HB3' ' NH1' ' A' ' 46' ' ' ARG . . . -76.66 -14.23 59.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.939 -0.573 . . . . 0.23 112.069 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.847 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 70.7 p -104.55 -18.25 14.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.757 -0.377 . . . . 0.17 111.694 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.16 35.04 87.95 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.51 -0.314 . . . . 0.29 113.372 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.1 10.47 36.67 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.325 -0.941 . . . . 0.37 111.364 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.847 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.2 t0 -94.09 87.14 5.2 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.241 -1.763 . . . . 0.64 106.241 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.761 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.74 -24.18 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 CA-C-N 114.644 -1.162 . . . . 0.52 111.058 -170.403 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -63.56 -52.2 62.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.716 -0.846 . . . . 1.29 108.716 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.72 -32.49 71.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.044 -0.98 . . . . 0.29 110.483 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -51.71 -51.71 53.93 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.573 0.225 . . . . 0.24 110.722 172.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.761 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.3 mt -61.32 -47.26 94.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 109.844 -0.428 . . . . 0.38 109.844 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.8 -20.67 65.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.414 . . . . 2.35 111.386 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.735 ' NH1' ' HA ' ' A' ' 32' ' ' ALA . 42.8 mtp180 -80.17 -34.67 37.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.883 0.373 . . . . 2.47 110.549 174.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.6 mt . . . . . 0 C--N 1.317 -0.829 0 CA-C-O 121.32 0.581 . . . . 0.45 110.416 177.613 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 . . . . . 0 C--O 1.234 0.255 0 CA-C-O 121.229 0.538 . . . . 2.74 110.069 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.789 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.8 m-85 -61.48 -54.79 38.66 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.744 -0.662 . . . . 0.56 111.845 -172.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 32.2 tt0 -59.72 -40.84 89.33 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.529 0.204 . . . . 1.26 111.197 -170.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -62.04 -48.0 82.21 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.499 0.666 . . . . 1.19 110.009 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.738 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.7 OUTLIER -66.45 -26.25 67.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.154 -0.93 . . . . 1.24 111.008 177.044 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.867 HD11 ' HB3' ' A' ' 30' ' ' LEU . 36.6 mt -73.35 -35.17 65.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.2 111.313 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 27.3 mt-10 -73.03 -27.15 61.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.558 0.694 . . . . 0.88 109.567 174.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 21' ' ' MET . 45.7 tt0 -65.09 -52.77 53.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.209 -0.905 . . . . 0.37 109.931 173.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.682 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 73.1 mt -62.49 -38.25 89.14 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.837 0.827 . . . . 0.17 108.982 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.3 t30 -49.87 -36.65 27.93 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.927 -1.488 . . . . 0.25 110.575 176.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 t -86.36 -19.3 29.97 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.949 -1.023 . . . . 0.66 110.227 -177.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.682 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 24.6 mmm -73.99 -19.97 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.122 -0.945 . . . . 1.41 110.016 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.24 15.63 15.44 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 110.57 -1.012 . . . . 0.19 110.57 -172.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 65.8 m-85 -113.65 107.2 15.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.075 0.464 . . . . 0.37 110.206 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.476 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -124.84 8.9 4.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.898 -0.592 . . . . 0.23 110.847 -174.821 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.59 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -76.12 79.68 2.94 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.242 -1.392 . . . . 1.84 107.242 172.143 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.73 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -46.73 -45.83 19.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 123.66 0.6 . . . . 1.63 111.193 -173.235 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 31' ' ' GLN . 2.3 mp0 -55.68 -46.98 77.48 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.858 0.724 . . . . 2.44 110.442 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.59 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -70.39 -44.32 68.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.338 -0.392 . . . . 0.26 110.269 -179.353 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.668 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.2 m-20 -54.0 -64.16 0.92 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.551 -0.75 . . . . 0.14 111.089 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.9 OUTLIER -73.56 -25.32 60.32 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.287 -0.565 . . . . 0.27 111.794 -172.932 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 27' ' ' GLU . 7.0 mm-40 -66.76 -28.56 68.5 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 118.542 0.61 . . . . 2.18 110.109 175.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.84 -32.9 62.05 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.928 -1.138 . . . . 0.12 107.928 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 11' ' ' PHE . 2.1 mp -76.82 -20.52 56.26 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.82 -1.082 . . . . 0.2 111.286 174.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 30' ' ' LEU . 23.9 mt -73.89 -38.99 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.129 -0.693 . . . . 0.34 109.129 176.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.81 -21.34 47.88 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.26 -0.882 . . . . 0.23 111.471 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 43.6 p -103.78 -18.74 14.55 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.922 0.391 . . . . 0.17 111.808 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.18 29.96 68.01 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.29 113.67 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.74 20.84 10.26 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.085 -1.055 . . . . 0.37 111.969 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.516 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 10.7 t0 -104.1 89.63 3.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.837 -1.542 . . . . 0.64 106.837 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.23 -26.14 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 114.414 -1.267 . . . . 0.52 111.597 -168.835 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -50.02 71.49 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.668 -0.864 . . . . 1.29 108.668 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.09 -33.06 73.83 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.098 -0.956 . . . . 0.29 110.55 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.45 -49.27 67.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.676 -0.238 . . . . 0.24 111.017 172.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.809 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -65.01 -39.92 87.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 N-CA-C 109.919 -0.4 . . . . 0.38 109.919 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.0 -24.43 67.03 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.007 -0.542 . . . . 2.35 110.858 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 52.7 mtt180 -83.05 -33.37 26.46 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.862 -0.335 . . . . 2.47 110.855 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--N 1.321 -0.648 0 CA-C-O 120.916 0.389 . . . . 0.45 111.144 179.579 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 . . . . . 0 C--O 1.24 0.581 0 CA-C-O 121.763 0.792 . . . . 2.74 109.13 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.661 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.5 m-30 -61.97 -55.47 29.04 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 114.81 -1.086 . . . . 0.56 111.462 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.547 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 51.0 tt0 -59.8 -33.28 71.52 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.836 -0.346 . . . . 1.26 111.642 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -62.83 -48.87 77.19 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.702 0.763 . . . . 1.19 109.403 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.508 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -68.89 -21.09 64.26 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.091 -0.959 . . . . 1.24 111.022 174.926 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.859 HD22 ' HB3' ' A' ' 29' ' ' ASN . 13.6 mt -74.37 -30.78 62.12 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 110.161 -0.311 . . . . 0.2 110.161 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.639 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 31.3 mt-10 -72.31 -30.0 64.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.886 0.85 . . . . 0.88 109.324 172.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 21' ' ' MET . 52.5 tt0 -66.44 -48.56 69.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.272 -0.876 . . . . 0.37 110.198 174.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.879 ' HG ' HD11 ' A' ' 40' ' ' ILE . 71.8 mt -68.73 -31.49 70.59 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.941 -0.763 . . . . 0.17 108.941 177.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.639 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 8.6 t30 -50.22 -37.21 34.35 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.202 -1.363 . . . . 0.25 109.817 173.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -86.68 -4.52 59.19 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.31 -1.314 . . . . 0.66 110.67 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.747 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 30.6 mtt -96.12 -9.2 31.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.542 0.687 . . . . 1.41 109.223 178.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.2 15.99 36.65 Favored Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.008 -0.996 . . . . 0.19 111.369 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.477 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 34.6 m-85 -108.84 110.64 22.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.411 0.624 . . . . 0.37 110.032 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.57 1.83 4.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 115.291 -0.868 . . . . 0.23 111.285 -174.549 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -72.05 78.05 0.93 Allowed 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.368 -1.345 . . . . 1.84 107.368 165.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 15.9 mmt85 -47.45 -35.3 8.36 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.964 -1.017 . . . . 1.63 109.95 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 35.9 mt-10 -53.31 -61.99 1.94 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.033 -0.985 . . . . 2.44 111.71 173.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.0 73.19 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.064 -0.254 . . . . 0.26 110.598 -174.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.859 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.3 m-20 -49.67 -64.3 0.85 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.036 -0.529 . . . . 0.14 110.639 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.8 pp -74.74 -24.81 58.77 Favored 'General case' 0 C--O 1.212 -0.918 0 C-N-CA 119.852 -0.739 . . . . 0.27 112.323 -173.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.542 ' N ' HD12 ' A' ' 30' ' ' LEU . 80.3 mm-40 -61.25 -34.78 75.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.683 0.754 . . . . 2.18 109.406 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.71 -33.5 64.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.503 -1.226 . . . . 0.12 108.784 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.764 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -76.56 -20.76 56.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.326 -0.852 . . . . 0.2 110.975 175.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.755 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.4 mt -70.12 -41.25 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 109.118 -0.697 . . . . 0.34 109.118 174.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.93 -33.48 70.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.386 -0.825 . . . . 0.23 111.267 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.747 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 80.7 p -96.12 -18.81 19.86 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.956 0.354 . . . . 0.17 111.956 -177.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.68 33.02 56.59 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.29 112.717 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.764 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.45 10.8 56.59 Favored Glycine 0 CA--C 1.499 -0.951 0 C-N-CA 120.476 -0.869 . . . . 0.37 111.229 176.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.747 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.8 t70 -87.66 88.66 7.73 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 106.43 -1.693 . . . . 0.64 106.43 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.879 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -70.86 -22.4 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.025 -0.989 . . . . 0.52 111.738 -166.636 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.99 -51.41 66.94 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.611 -0.885 . . . . 1.29 108.611 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -65.8 -34.1 77.38 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.725 -1.125 . . . . 0.29 109.95 177.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 40' ' ' ILE . . . -58.75 -48.86 79.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.266 -0.424 . . . . 0.24 111.496 176.088 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.828 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.0 mt -62.9 -45.77 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 N-CA-C 109.96 -0.385 . . . . 0.38 109.96 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HG2' ' HA ' ' A' ' 42' ' ' ALA . 9.3 pt-20 -69.26 -19.41 63.92 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.495 -0.482 . . . . 2.35 110.593 -177.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 48.0 mtt180 -78.17 -35.8 48.31 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 120.58 -0.448 . . . . 2.47 109.981 173.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.45 110.71 178.785 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 . . . . . 0 C--O 1.238 0.451 0 N-CA-C 108.723 -0.843 . . . . 2.74 108.723 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.698 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.7 m-30 -61.2 -50.74 71.88 Favored 'General case' 0 C--O 1.214 -0.801 0 CA-C-N 114.515 -1.22 . . . . 0.56 109.92 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.0 tt0 -56.01 -39.46 71.95 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 123.207 0.317 . . . . 1.26 111.389 -177.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -63.37 -44.86 93.58 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.671 0.748 . . . . 1.19 109.502 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.672 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.0 OUTLIER -73.66 -19.28 60.88 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.189 -0.914 . . . . 1.24 111.216 175.166 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.9 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.6 mt -77.88 -36.24 49.94 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 110.04 -0.355 . . . . 0.2 110.04 -178.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 29.0 mt-10 -70.79 -29.02 65.1 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.77 0.669 . . . . 0.88 109.64 172.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -66.28 -51.7 54.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.37 110.045 174.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.872 ' HG ' HD11 ' A' ' 40' ' ' ILE . 79.5 mt -63.61 -34.74 78.5 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.938 0.875 . . . . 0.17 108.885 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.625 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.2 t30 -53.19 -34.87 58.81 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.902 -1.499 . . . . 0.25 110.266 175.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.4 t -86.8 -12.01 49.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.625 -1.17 . . . . 0.66 110.01 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.9 mmm -90.86 -5.55 55.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.266 -0.879 . . . . 1.41 109.892 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.17 15.99 39.61 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.323 -0.853 . . . . 0.19 111.195 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.503 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.4 m-85 -111.42 107.41 16.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.135 0.493 . . . . 0.37 109.771 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.485 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -127.29 8.44 3.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.802 -0.635 . . . . 0.23 111.322 -173.622 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.96 85.7 7.1 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 106.423 -1.695 . . . . 1.84 106.423 170.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.836 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.2 mmp_? -42.81 -47.52 5.53 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.069 0.856 . . . . 1.63 110.555 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -44.39 -57.1 3.73 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.587 1.18 . . . . 2.44 111.275 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.09 64.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.888 0.375 . . . . 0.26 110.347 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.804 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.7 -65.03 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.162 -0.926 . . . . 0.14 111.556 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.9 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.7 pp -73.15 -28.11 62.05 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 119.126 -0.464 . . . . 0.27 111.969 -172.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.56 ' N ' HD12 ' A' ' 30' ' ' LEU . 46.9 mt-30 -60.09 -37.02 78.71 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.731 0.776 . . . . 2.18 109.678 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -72.17 -31.67 66.14 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.363 -1.29 . . . . 0.12 108.814 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.768 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -79.33 -19.59 49.98 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.218 -0.901 . . . . 0.2 111.17 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.1 mt -71.09 -44.18 75.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.777 -0.823 . . . . 0.34 108.777 173.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.97 -27.21 66.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.202 -0.908 . . . . 0.23 111.287 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.832 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 54.7 p -101.73 -19.38 15.4 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.53 0.567 . . . . 0.17 112.53 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.52 26.12 72.53 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.06 -0.59 . . . . 0.29 112.201 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.768 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 98.44 18.76 25.07 Favored Glycine 0 CA--C 1.5 -0.855 0 C-N-CA 120.66 -0.781 . . . . 0.37 111.472 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.832 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 18.4 t70 -94.04 87.87 5.48 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.395 -1.705 . . . . 0.64 106.395 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.872 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -68.94 -23.92 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 114.849 -1.068 . . . . 0.52 110.923 -166.735 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 60.3 m-20 -52.51 -57.39 10.07 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.25 0.548 . . . . 1.29 109.717 173.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' A' ' 45' ' ' GLU . . . -72.55 -22.32 61.03 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.319 -0.855 . . . . 0.29 111.09 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.445 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -58.23 -48.63 79.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 121.162 -0.215 . . . . 0.24 110.585 168.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.449 HD13 ' CE ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -70.74 -32.98 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 120.544 -0.462 . . . . 0.38 110.753 177.873 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 6.9 mm-40 -61.61 -22.72 65.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.087 0.47 . . . . 2.35 110.098 174.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -88.76 -44.59 10.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.954 -0.566 . . . . 2.47 111.195 175.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-O 120.855 0.359 . . . . 0.45 111.678 -179.473 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 . . . . . 0 C--O 1.242 0.66 0 N-CA-C 108.76 -0.83 . . . . 2.74 108.76 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.786 ' HA ' HD22 ' A' ' 33' ' ' LEU . 17.7 m-30 -62.55 -55.28 28.78 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 114.937 -1.029 . . . . 0.56 111.968 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.484 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 50.8 tt0 -56.97 -42.43 80.16 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.778 0.288 . . . . 1.26 111.778 -172.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -60.17 -45.75 92.01 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.649 0.737 . . . . 1.19 110.181 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.724 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -72.77 -21.0 61.07 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.892 -1.049 . . . . 1.24 111.444 176.348 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.854 HD22 ' HB3' ' A' ' 29' ' ' ASN . 11.8 mt -73.73 -37.6 65.06 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.267 -0.271 . . . . 0.2 110.267 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 29.8 mt-10 -69.68 -28.7 66.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.721 0.772 . . . . 0.88 109.376 174.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.8 tt0 -67.51 -46.33 73.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.407 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.541 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 42.6 mt -67.56 -31.9 72.29 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.082 0.944 . . . . 0.17 108.914 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.558 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.3 t30 -57.07 -30.5 64.34 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 113.633 -1.621 . . . . 0.25 109.966 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -83.11 -19.8 36.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.478 -1.237 . . . . 0.66 109.9 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 13.3 mmt -80.18 -17.55 52.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.135 -0.939 . . . . 1.41 109.889 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.25 13.45 28.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.391 -1.083 . . . . 0.19 110.391 -171.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.6 m-85 -105.14 108.89 20.65 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.298 0.57 . . . . 0.37 110.856 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -125.33 13.02 4.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.627 -0.715 . . . . 0.23 111.367 -174.837 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 1.8 t-20 -84.99 80.25 9.36 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 106.736 -1.579 . . . . 1.84 106.736 173.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.771 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.1 mmp_? -43.18 -49.23 6.53 Favored 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.934 0.771 . . . . 1.63 111.322 -174.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -47.73 -55.93 8.46 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 124.602 1.189 . . . . 2.44 110.537 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.542 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -66.75 -46.91 73.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.144 -0.48 . . . . 0.26 110.744 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.854 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.05 -64.23 0.85 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.641 -0.709 . . . . 0.14 111.31 177.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.6 pp -71.84 -27.31 62.81 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 120.376 -0.53 . . . . 0.27 111.976 -174.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.504 ' N ' HD12 ' A' ' 30' ' ' LEU . 16.6 mm-40 -65.03 -30.85 71.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.348 0.594 . . . . 2.18 109.93 176.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.88 -32.89 61.98 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.574 -0.899 . . . . 0.12 108.574 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.9 mp -73.95 -23.7 59.54 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.21 -0.905 . . . . 0.2 111.334 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.4 mt -72.18 -37.55 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.278 -0.638 . . . . 0.34 109.278 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.8 -27.5 60.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.723 -0.671 . . . . 0.23 111.305 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.672 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 66.0 p -99.95 -17.96 17.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.298 -0.41 . . . . 0.17 111.696 -177.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.99 29.77 70.5 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.29 113.056 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.03 22.0 10.44 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 119.979 -1.105 . . . . 0.37 111.48 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.672 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t0 -104.51 89.09 3.11 Favored 'General case' 0 CA--C 1.499 -1.011 0 N-CA-C 106.597 -1.631 . . . . 0.64 106.597 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.711 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -66.95 -25.14 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 CA-C-N 114.374 -1.285 . . . . 0.52 111.599 -168.316 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.18 -49.34 74.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.579 -0.897 . . . . 1.29 108.579 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.624 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -67.95 -33.43 74.64 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.851 -1.068 . . . . 0.29 110.077 177.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.49 67.65 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 111.376 0.139 . . . . 0.24 111.376 173.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -40.14 87.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 CA-C-O 120.744 0.306 . . . . 0.38 110.226 178.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -67.9 -19.62 65.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.233 -0.44 . . . . 2.35 110.585 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 57.3 mtp85 -77.79 -47.73 18.24 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.158 -0.617 . . . . 2.47 109.597 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.462 HD11 HD13 ' A' ' 18' ' ' LEU . 24.3 mt . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.272 -0.876 . . . . 0.45 111.485 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 . . . . . 0 C--O 1.242 0.659 0 CA-C-O 121.663 0.744 . . . . 2.74 110.001 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.665 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 12.5 m-30 -62.39 -54.91 33.43 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 115.005 -0.998 . . . . 0.56 112.204 -174.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 tt0 -58.84 -36.87 75.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.197 -0.201 . . . . 1.26 111.049 -173.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -64.18 -41.46 97.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.813 0.816 . . . . 1.19 109.937 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.79 ' HB3' HG13 ' A' ' 40' ' ' ILE . 33.4 mt-30 -74.98 -21.12 59.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.118 -0.946 . . . . 1.24 110.931 175.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 30' ' ' LEU . 20.1 mt -75.46 -36.67 60.65 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.591 -0.277 . . . . 0.2 110.317 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.6 mt-10 -73.43 -26.02 60.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.499 0.666 . . . . 0.88 109.975 174.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -66.97 -50.87 60.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.267 -0.878 . . . . 0.37 109.723 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.852 ' HG ' HD11 ' A' ' 40' ' ' ILE . 33.0 mt -63.37 -34.71 78.31 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.9 0.857 . . . . 0.17 109.135 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 5.4 t30 -53.92 -34.93 60.99 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.031 -1.441 . . . . 0.25 110.275 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 t -87.23 -6.2 58.66 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.558 -1.201 . . . . 0.66 109.822 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.564 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 7.2 mmm -98.33 -4.72 34.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.966 -1.016 . . . . 1.41 109.864 -178.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.69 18.23 33.24 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.3 -0.864 . . . . 0.19 111.295 -177.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.513 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 60.8 m-85 -113.4 109.32 18.5 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.116 0.484 . . . . 0.37 109.764 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.529 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -126.98 0.88 3.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.054 -0.521 . . . . 0.23 111.596 -172.873 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.69 82.31 3.32 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.117 -1.438 . . . . 1.84 107.117 171.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.5 mmp_? -41.64 -49.0 4.19 Favored 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 124.011 0.819 . . . . 1.63 110.933 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 2.4 mm-40 -43.59 -58.57 2.58 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.729 1.268 . . . . 2.44 110.588 176.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.83 -49.23 63.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.26 110.723 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.797 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.1 m-20 -45.55 -64.25 0.77 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.745 0.653 . . . . 0.14 111.385 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.1 pp -72.99 -27.01 61.55 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-O 119.006 -0.521 . . . . 0.27 112.189 -173.308 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.509 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.9 mm100 -60.78 -35.33 76.16 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.711 0.767 . . . . 2.18 109.389 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.469 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -73.12 -33.16 65.38 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.563 -1.199 . . . . 0.12 108.718 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.62 HD21 ' CB ' ' A' ' 14' ' ' GLN . 2.3 mp -75.84 -25.61 56.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.164 -0.926 . . . . 0.2 111.387 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 30' ' ' LEU . 5.3 mt -73.99 -32.71 34.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.394 0.616 . . . . 0.34 109.391 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.624 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -79.55 -23.54 42.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.455 -0.793 . . . . 0.23 111.139 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 45.7 p -104.79 -17.98 14.41 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.214 0.45 . . . . 0.17 112.214 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.72 32.21 70.61 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 121.408 -0.425 . . . . 0.29 113.051 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.93 37.88 5.06 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 119.884 -1.15 . . . . 0.37 111.43 176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.458 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t70 -119.38 87.11 2.68 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 106.119 -1.808 . . . . 0.64 106.119 172.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.868 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -65.55 -24.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.557 0 CA-C-N 113.836 -1.529 . . . . 0.52 111.644 -166.597 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -62.03 -50.44 72.01 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.938 -0.764 . . . . 1.29 108.938 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.584 ' O ' ' HG3' ' A' ' 45' ' ' GLU . . . -68.88 -32.13 71.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.876 -1.056 . . . . 0.29 110.367 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.523 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -56.14 -49.85 72.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 121.26 -0.176 . . . . 0.24 110.882 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.868 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.6 mt -63.29 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.699 0.285 . . . . 0.38 110.812 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.584 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -72.99 -19.6 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.745 -0.382 . . . . 2.35 110.585 -176.3 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.624 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 75.3 mtt180 -84.85 -27.11 26.95 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.974 0.416 . . . . 2.47 110.409 173.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 96.2 mt . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 0.45 110.071 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? . . . . . 0 C--O 1.238 0.45 0 CA-C-O 121.581 0.705 . . . . 2.74 109.156 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.806 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.2 m-30 -61.54 -54.6 40.93 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.849 -1.069 . . . . 0.56 111.375 -172.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.616 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 63.2 tt0 -59.54 -34.34 72.52 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 121.235 -0.186 . . . . 1.26 111.492 -172.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -65.02 -47.42 77.5 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.578 0.704 . . . . 1.19 109.427 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.752 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.1 mp0 -69.6 -19.28 63.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.282 -0.872 . . . . 1.24 111.203 174.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.641 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.5 mt -73.75 -40.2 63.67 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.621 -0.511 . . . . 0.2 109.621 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 33.3 mt-10 -64.54 -31.35 72.53 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.827 0.822 . . . . 0.88 109.59 173.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.497 ' O ' ' HG2' ' A' ' 21' ' ' MET . 44.6 tt0 -66.83 -50.63 61.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.096 -0.956 . . . . 0.37 111.056 175.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.681 ' HG ' HD11 ' A' ' 40' ' ' ILE . 62.0 mt -66.37 -30.15 70.47 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.854 0.835 . . . . 0.17 108.871 177.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.9 t30 -54.23 -35.29 62.3 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.051 -1.431 . . . . 0.25 110.3 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 t -87.1 -3.74 59.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.727 -1.124 . . . . 0.66 110.027 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.619 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 31.6 mmm -97.48 -8.38 29.38 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.306 -0.861 . . . . 1.41 109.718 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.28 16.89 33.39 Favored Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.27 -0.877 . . . . 0.19 111.153 -176.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.52 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.3 m-85 -110.63 109.52 19.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.37 109.879 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.76 -8.06 10.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.764 -0.653 . . . . 0.23 111.43 -172.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -73.13 83.14 1.3 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.94 -1.504 . . . . 1.84 106.94 169.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.89 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 57.2 mtt85 -60.98 -26.01 67.26 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.218 -0.446 . . . . 1.63 110.717 -175.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -52.76 -50.5 63.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.433 -0.58 . . . . 2.44 109.433 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.52 -46.26 60.14 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.987 -0.551 . . . . 0.26 110.421 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' CB ' HD22 ' A' ' 15' ' ' LEU . 6.6 m-20 -50.82 -60.41 3.09 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.659 -0.701 . . . . 0.14 111.268 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.89 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 2.0 pp -73.87 -24.22 59.71 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 120.294 -0.563 . . . . 0.27 112.343 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.546 ' N ' HD12 ' A' ' 30' ' ' LEU . 11.0 mm100 -60.85 -34.66 74.93 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.88 0.848 . . . . 2.18 109.328 172.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -31.17 61.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.285 -1.325 . . . . 0.12 108.176 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.806 HD22 ' HA ' ' A' ' 11' ' ' PHE . 0.9 OUTLIER -79.68 -22.06 43.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.166 -0.925 . . . . 0.2 111.233 177.289 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.752 HG13 ' O ' ' A' ' 30' ' ' LEU . 6.0 mt -73.33 -38.5 53.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.641 -0.503 . . . . 0.34 109.641 175.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.6 -22.16 54.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.852 -0.613 . . . . 0.23 111.152 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.476 ' OG1' ' HA ' ' A' ' 33' ' ' LEU . 46.4 p -102.86 -18.78 14.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.338 0.496 . . . . 0.17 112.338 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.93 28.86 59.94 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 121.343 -0.456 . . . . 0.29 113.241 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.748 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 103.07 10.17 37.54 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.103 -1.046 . . . . 0.37 111.487 176.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.474 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.3 t70 -96.52 87.88 4.53 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 107.117 -1.438 . . . . 0.64 107.117 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.8 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -64.59 -25.72 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-N 114.11 -1.404 . . . . 0.52 111.536 -169.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 5.5 m-80 -60.51 -53.91 51.8 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.829 -0.804 . . . . 1.29 108.829 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.26 -30.9 70.04 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.437 -0.801 . . . . 0.29 110.559 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -46.32 74.0 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.395 -0.366 . . . . 0.24 110.543 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.8 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -68.13 -37.53 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.892 -0.41 . . . . 0.38 109.892 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 41' ' ' ASN . 51.0 mt-10 -65.7 -21.12 66.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.93 -0.577 . . . . 2.35 110.935 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 54.1 mtt180 -87.33 -40.95 14.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.312 -0.404 . . . . 2.47 110.845 176.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.995 0.426 . . . . 0.45 110.685 177.472 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 . . . . . 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 2.74 110.151 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.651 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 17.2 m-30 -61.44 -54.55 42.02 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 115.238 -0.892 . . . . 0.56 110.318 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.1 tt0 -55.78 -35.56 66.39 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 123.368 0.417 . . . . 1.26 111.51 -175.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -64.56 -49.65 70.38 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.566 0.698 . . . . 1.19 109.267 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.506 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -68.75 -19.04 64.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.147 -0.933 . . . . 1.24 111.038 174.378 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.3 mt -75.97 -35.85 59.49 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 122.027 -0.42 . . . . 0.2 110.083 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 30.7 mt-10 -71.93 -25.6 61.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.538 0.685 . . . . 0.88 109.362 173.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -70.01 -46.28 65.44 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.444 -0.798 . . . . 0.37 110.569 174.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.886 ' HG ' HD11 ' A' ' 40' ' ' ILE . 63.7 mt -69.47 -33.56 73.08 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.281 -1.007 . . . . 0.17 108.281 177.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 6.1 t30 -51.8 -35.01 42.58 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.482 -1.69 . . . . 0.25 110.146 173.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.6 t -86.57 -11.1 52.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.592 -1.186 . . . . 0.66 110.378 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.651 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.2 mmm -90.45 -13.26 35.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.716 -0.675 . . . . 1.41 110.204 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.02 13.32 27.49 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-N 115.386 -0.825 . . . . 0.19 111.349 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.423 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m-85 -111.12 107.96 17.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.244 0.545 . . . . 0.37 110.392 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.49 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -123.79 6.22 5.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.94 -0.573 . . . . 0.23 111.37 -174.526 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.9 79.16 2.8 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.383 -1.339 . . . . 1.84 107.383 167.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.795 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 9.0 mmt85 -46.36 -39.48 10.4 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.574 -0.739 . . . . 1.63 109.926 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -46.94 -62.19 1.52 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.649 -1.16 . . . . 2.44 111.429 172.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.77 -39.69 66.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.802 -0.359 . . . . 0.26 110.76 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.786 ' HB3' HD22 ' A' ' 15' ' ' LEU . 7.3 m-20 -49.34 -64.95 0.66 Allowed 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 123.284 0.365 . . . . 0.14 111.082 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.895 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.3 pp -74.98 -26.53 59.64 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 119.835 -0.746 . . . . 0.27 112.364 -171.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.595 ' N ' HD12 ' A' ' 30' ' ' LEU . 88.8 mt-30 -63.65 -33.3 75.32 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.763 0.792 . . . . 2.18 109.661 176.152 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.45 67.23 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.499 -1.228 . . . . 0.12 108.541 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.745 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -74.78 -23.24 58.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.316 -0.857 . . . . 0.2 110.935 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.773 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.6 mt -70.72 -36.85 66.75 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.649 0.738 . . . . 0.34 109.246 175.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.593 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -78.65 -20.52 50.08 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.055 -0.975 . . . . 0.23 111.501 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 63.3 p -108.36 -19.1 13.58 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.852 -0.339 . . . . 0.17 111.817 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.8 26.46 58.54 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 121.473 -0.394 . . . . 0.29 112.908 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.745 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 97.69 16.87 32.47 Favored Glycine 0 CA--C 1.497 -1.059 0 C-N-CA 120.2 -1.0 . . . . 0.37 111.311 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.621 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.0 t70 -93.13 93.06 8.08 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 105.405 -2.072 . . . . 0.64 105.405 170.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.886 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.77 -25.05 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-N 114.862 -1.063 . . . . 0.52 111.355 -166.798 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -59.52 -52.03 67.29 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.295 -0.631 . . . . 1.29 109.295 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' GLU . . . -69.8 -27.18 64.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.318 -0.855 . . . . 0.29 110.288 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.497 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -61.65 -49.2 77.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.24 110.859 173.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.83 HG13 ' O ' ' A' ' 40' ' ' ILE . 2.6 mt -65.88 -38.63 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 120.685 0.278 . . . . 0.38 110.264 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 42' ' ' ALA . 6.4 pt-20 -66.71 -24.24 66.22 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.905 -0.318 . . . . 2.35 110.487 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.593 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 61.0 mtt180 -82.17 -29.67 31.41 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.626 -0.43 . . . . 2.47 110.091 175.094 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 44' ' ' ILE . 91.4 mt . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.263 -0.426 . . . . 0.45 110.808 177.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 . . . . . 0 C--O 1.238 0.453 0 CA-C-O 121.32 0.581 . . . . 2.74 109.793 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.731 ' HA ' HD22 ' A' ' 33' ' ' LEU . 18.3 m-30 -62.36 -55.21 30.23 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.308 -0.86 . . . . 0.56 111.679 -171.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.584 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 29.4 tt0 -58.68 -37.49 76.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 117.931 0.332 . . . . 1.26 110.979 -171.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -59.8 -52.07 67.04 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 122.212 1.006 . . . . 1.19 109.395 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.687 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -70.24 -20.04 63.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.182 -1.372 . . . . 1.24 111.365 178.289 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.0 mt -74.92 -35.09 62.2 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 122.348 -0.22 . . . . 0.2 110.652 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 34.3 mt-10 -70.68 -29.84 66.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.786 0.803 . . . . 0.88 109.18 173.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.402 ' HB3' ' O ' ' A' ' 14' ' ' GLN . 48.0 tt0 -66.28 -48.14 71.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.976 -1.011 . . . . 0.37 110.489 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.873 ' HG ' HD11 ' A' ' 40' ' ' ILE . 67.1 mt -69.59 -31.86 70.26 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.849 -0.797 . . . . 0.17 108.849 177.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.64 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.7 t30 -50.92 -34.35 28.12 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.181 -1.372 . . . . 0.25 110.062 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -86.71 -14.96 40.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.415 -1.266 . . . . 0.66 110.61 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 23.5 mtt -85.41 -10.76 55.78 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.488 0.661 . . . . 1.41 109.961 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.34 10.91 43.5 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 110.808 -0.917 . . . . 0.19 110.808 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.0 m-85 -107.73 109.32 20.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.582 0.706 . . . . 0.37 110.625 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.53 9.8 3.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 115.554 -0.748 . . . . 0.23 111.063 -174.257 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.585 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 1.7 t-20 -79.34 79.8 5.76 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 106.882 -1.525 . . . . 1.84 106.882 172.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.769 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 58.7 mmt-85 -46.04 -44.46 15.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.891 0.745 . . . . 1.63 111.948 -171.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.6 -49.98 75.67 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.514 0.508 . . . . 2.44 110.304 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -64.06 -47.77 78.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.18 -0.304 . . . . 0.26 110.18 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.773 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.5 m-20 -48.48 -63.46 1.08 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.656 -0.702 . . . . 0.14 111.036 176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.808 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.2 pp -73.8 -25.46 60.13 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 120.307 -0.557 . . . . 0.27 112.395 -172.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 30' ' ' LEU . 70.7 mt-30 -64.32 -32.48 74.1 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.753 0.787 . . . . 2.18 109.848 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -73.4 -33.46 64.99 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.861 -1.063 . . . . 0.12 108.591 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.8 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -75.19 -24.61 57.85 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.09 -0.959 . . . . 0.2 110.991 175.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.779 HG13 ' O ' ' A' ' 30' ' ' LEU . 26.4 mt -67.75 -48.29 76.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.363 -0.606 . . . . 0.34 109.363 175.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.4 -28.0 68.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.432 -0.804 . . . . 0.23 111.681 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.699 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 40.2 p -98.49 -18.76 18.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.865 0.364 . . . . 0.17 111.921 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.53 21.32 60.32 Favored Glycine 0 C--N 1.322 -0.23 0 C-N-CA 121.202 -0.523 . . . . 0.29 112.346 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.8 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.77 16.5 38.94 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 111.047 -0.821 . . . . 0.37 111.047 -178.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 19.7 t70 -90.89 87.73 6.75 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 106.041 -1.837 . . . . 0.64 106.041 175.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.873 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -73.54 -27.11 22.83 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.955 -1.02 . . . . 0.52 113.02 -158.495 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 8.8 p30 -60.97 -43.25 99.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.91 -0.774 . . . . 1.29 108.91 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -72.69 -30.6 64.36 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.022 -0.99 . . . . 0.29 110.639 176.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.52 91.53 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.468 -0.333 . . . . 0.24 110.83 172.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.1 mt -65.98 -38.71 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 N-CA-C 109.356 -0.609 . . . . 0.38 109.356 176.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 21.5 mm-40 -58.19 -30.39 66.39 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.505 -0.77 . . . . 2.35 110.41 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.3 mtp85 -77.96 -43.73 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.687 0.28 . . . . 2.47 110.742 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.6 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 0.45 111.493 -177.684 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 . . . . . 0 C--O 1.242 0.658 0 CA-C-O 122.041 0.924 . . . . 2.74 108.684 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.648 ' HA ' HD22 ' A' ' 33' ' ' LEU . 2.8 m-85 -60.88 -51.42 69.37 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.196 -1.366 . . . . 0.56 110.182 -176.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 38.4 tt0 -58.24 -33.6 69.53 Favored 'General case' 0 C--O 1.222 -0.387 0 O-C-N 123.202 0.314 . . . . 1.26 111.552 -174.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -65.3 -49.5 69.28 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.475 0.655 . . . . 1.19 109.491 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.704 ' HB2' HD21 ' A' ' 33' ' ' LEU . 1.3 mp0 -66.97 -20.74 65.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.508 -0.769 . . . . 1.24 110.728 174.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' A' ' 29' ' ' ASN . 15.5 mt -78.18 -35.6 48.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.102 -0.499 . . . . 0.2 110.907 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.677 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.1 mt-10 -64.8 -34.29 78.01 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.78 0.8 . . . . 0.88 108.863 172.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.538 ' O ' ' HG2' ' A' ' 21' ' ' MET . 44.1 tt0 -63.92 -52.74 58.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.734 -1.121 . . . . 0.37 110.877 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.674 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 48.0 mt -64.67 -35.3 80.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.838 0.828 . . . . 0.17 109.128 177.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 7.6 t30 -53.95 -34.25 59.14 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.969 -1.469 . . . . 0.25 110.371 176.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 t -87.06 -14.75 40.6 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.159 -1.382 . . . . 0.66 110.012 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.674 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 26.0 mmm -82.21 -17.77 44.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.007 -0.997 . . . . 1.41 110.009 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.46 10.84 30.46 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.09 -0.959 . . . . 0.19 110.943 -172.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 50.3 m-85 -103.77 106.15 16.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.382 0.61 . . . . 0.37 110.414 178.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.07 15.87 3.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.701 -0.681 . . . . 0.23 111.469 -177.021 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 54.6 t30 -84.22 84.19 7.71 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.41 -1.7 . . . . 1.84 106.41 171.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.785 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mmp_? -45.85 -49.62 15.13 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 123.842 0.714 . . . . 1.63 111.762 -172.424 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -53.89 -51.23 64.35 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 123.953 0.783 . . . . 2.44 110.931 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.482 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -60.09 -52.66 64.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.689 0.281 . . . . 0.26 110.293 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.799 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.6 m-20 -48.0 -64.34 0.82 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.46 -0.791 . . . . 0.14 111.568 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.7 pp -73.93 -25.04 59.76 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 120.432 -0.507 . . . . 0.27 112.124 -172.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.481 ' N ' HD12 ' A' ' 30' ' ' LEU . 72.6 mt-30 -62.45 -35.64 79.94 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.865 0.841 . . . . 2.18 109.295 174.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.54 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -71.98 -33.08 67.85 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.471 -1.24 . . . . 0.12 108.49 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.704 HD21 ' HB2' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -78.01 -20.04 53.28 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.588 -1.187 . . . . 0.2 111.166 176.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.759 HG13 ' O ' ' A' ' 30' ' ' LEU . 34.6 mt -68.9 -49.08 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 109.053 -0.721 . . . . 0.34 109.053 174.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.03 -20.66 60.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.491 -0.777 . . . . 0.23 112.016 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.815 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 60.8 p -102.43 -18.72 15.24 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.585 -0.446 . . . . 0.17 111.874 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.74 26.13 74.76 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.315 -0.469 . . . . 0.29 113.533 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.99 20.98 8.01 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.398 -0.906 . . . . 0.37 111.729 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.815 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 63.0 t0 -103.9 87.17 2.73 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 106.735 -1.579 . . . . 0.64 106.735 176.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.675 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -65.85 -28.83 45.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-N 113.927 -1.488 . . . . 0.52 111.437 -167.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -61.43 -47.13 87.12 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.59 0.71 . . . . 1.29 109.251 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.662 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -75.25 -29.46 60.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.067 -0.97 . . . . 0.29 109.968 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.522 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -54.51 -45.07 73.22 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.24 110.294 171.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 40' ' ' ILE . 0.9 OUTLIER -68.34 -37.85 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 109.646 -0.501 . . . . 0.38 109.646 177.994 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -60.7 -20.09 60.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.892 -0.595 . . . . 2.35 110.688 174.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.662 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 64.1 mtp85 -87.6 -42.42 12.72 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.595 -0.442 . . . . 2.47 110.336 177.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.433 HD11 HD13 ' A' ' 18' ' ' LEU . 79.6 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.783 -0.644 . . . . 0.45 110.665 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 112.093 -0.403 . . . . 6.75 112.093 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.73 123.46 13.34 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.849 2.366 . . . . 6.37 111.294 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 92.7 mt -84.74 110.62 18.92 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.931 -0.577 . . . . 4.58 111.788 -173.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.01 -6.01 88.88 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.233 -0.747 . . . . 1.5 111.233 171.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.0 m -87.0 47.68 1.54 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.942 0.877 . . . . 1.68 109.007 174.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.475 ' HB2' ' HE2' ' A' ' 6' ' ' MET . 44.3 mtm -145.23 65.81 12.03 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.55 -1.648 . . . . 2.28 106.55 174.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -52.31 -34.64 61.0 Favored 'Trans proline' 0 CA--C 1.522 -0.124 0 C-N-CA 123.519 2.813 . . . . 0.92 114.685 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.65 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 26.0 mt-10 -68.56 -16.89 64.02 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 120.482 -0.487 . . . . 1.2 111.926 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.0 t -65.59 -24.26 34.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.435 0.636 . . . . 0.61 109.701 175.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -102.13 -48.15 4.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.578 0.704 . . . . 2.74 109.438 171.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.933 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.0 m-30 -62.06 -55.15 31.97 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 114.959 -1.019 . . . . 0.56 111.392 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.486 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 30.7 tt0 -62.5 -30.7 71.47 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.03 0.206 . . . . 1.26 111.195 -170.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -73.19 -44.9 59.05 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.103 -0.702 . . . . 1.19 109.103 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.665 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.2 mp0 -62.49 -24.98 67.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.387 -0.824 . . . . 1.24 109.996 171.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 29' ' ' ASN . 12.2 mt -72.47 -35.23 68.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.227 -0.442 . . . . 0.2 110.077 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.591 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 27.1 mt-10 -67.07 -34.36 77.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.85 0.833 . . . . 0.88 109.639 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 20' ' ' SER . 51.8 tt0 -66.82 -46.8 74.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.497 178.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 23' ' ' PHE . 52.4 mt -67.0 -32.5 73.78 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.918 0.866 . . . . 0.17 109.22 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.618 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.8 t30 -56.53 -28.21 59.47 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.976 -1.466 . . . . 0.25 110.524 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 17' ' ' GLN . 71.2 m -81.06 -19.56 43.49 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.92 -1.491 . . . . 0.66 110.112 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.5 mmm -98.75 3.79 47.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.18 -1.373 . . . . 1.41 110.55 -172.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.9 16.75 55.75 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.231 -0.895 . . . . 0.19 111.073 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 59.6 m-85 -108.01 104.28 13.69 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.362 0.601 . . . . 0.37 109.591 177.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.447 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -121.46 4.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.47 -0.786 . . . . 0.23 110.895 -175.854 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.474 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 18.4 t-20 -78.47 81.8 4.78 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.59 -1.633 . . . . 1.84 106.59 171.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.764 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.0 mmp_? -43.01 -48.63 6.02 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.839 0.712 . . . . 1.63 110.926 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -45.73 -57.72 4.03 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.249 0.968 . . . . 2.44 111.161 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.474 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -63.73 -49.48 72.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.524 -0.307 . . . . 0.26 110.987 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.867 ' HB3' HD22 ' A' ' 15' ' ' LEU . 3.7 m-20 -48.28 -62.9 1.25 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 123.77 0.669 . . . . 0.14 111.551 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.4 pp -75.08 -24.48 58.16 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.173 -0.611 . . . . 0.27 112.294 -173.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.47 ' N ' HD12 ' A' ' 30' ' ' LEU . 63.4 mm-40 -64.98 -32.64 74.47 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 122.057 0.932 . . . . 2.18 109.399 174.074 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.735 ' HA ' ' NH1' ' A' ' 46' ' ' ARG . . . -70.84 -38.19 73.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.314 -1.312 . . . . 0.12 107.835 177.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.0 OUTLIER -73.47 -21.8 60.33 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.719 -1.128 . . . . 0.2 111.596 176.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.698 HG13 ' O ' ' A' ' 30' ' ' LEU . 12.0 mt -68.29 -49.65 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 N-CA-C 109.801 -0.444 . . . . 0.34 109.801 176.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.558 ' HB3' ' NH1' ' A' ' 46' ' ' ARG . . . -76.66 -14.23 59.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.939 -0.573 . . . . 0.23 112.069 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.847 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 70.7 p -104.55 -18.25 14.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.757 -0.377 . . . . 0.17 111.694 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.16 35.04 87.95 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.51 -0.314 . . . . 0.29 113.372 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.1 10.47 36.67 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.325 -0.941 . . . . 0.37 111.364 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.847 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.2 t0 -94.09 87.14 5.2 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.241 -1.763 . . . . 0.64 106.241 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.761 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.74 -24.18 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 CA-C-N 114.644 -1.162 . . . . 0.52 111.058 -170.403 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -63.56 -52.2 62.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.716 -0.846 . . . . 1.29 108.716 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.72 -32.49 71.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.044 -0.98 . . . . 0.29 110.483 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -51.71 -51.71 53.93 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.573 0.225 . . . . 0.24 110.722 172.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.761 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.3 mt -61.32 -47.26 94.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 109.844 -0.428 . . . . 0.38 109.844 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.8 -20.67 65.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.414 . . . . 2.35 111.386 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.735 ' NH1' ' HA ' ' A' ' 32' ' ' ALA . 42.8 mtp180 -80.17 -34.67 37.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.883 0.373 . . . . 2.47 110.549 174.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.0 -35.87 66.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.32 0.581 . . . . 0.45 110.416 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.679 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 11.9 mt -82.13 -38.75 24.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.68 -0.691 . . . . 1.76 109.816 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -89.25 -46.54 4.37 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.038 -0.983 . . . . 1.28 112.86 -173.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -97.18 77.95 2.72 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.347 0.594 . . . . 4.31 110.63 -177.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -123.29 85.47 2.42 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.934 -1.135 . . . . 5.65 107.934 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -92.17 91.01 7.56 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.442 -1.254 . . . . 9.0 110.58 -171.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 m . . . . . 0 C--O 1.246 0.914 0 CA-C-N 114.993 -1.003 . . . . 10.04 109.671 179.234 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.83 0 N-CA-C 111.958 -0.457 . . . . 6.75 111.958 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -68.57 166.06 27.13 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.909 2.406 . . . . 6.37 111.628 175.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 2.0 pt? -67.39 100.36 0.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.488 0.661 . . . . 4.58 110.935 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.11 -137.85 32.18 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 114.88 -1.055 . . . . 1.5 112.755 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.0 m -113.89 53.55 0.78 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.437 0.637 . . . . 1.68 109.98 177.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.671 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 11.5 ptm -143.43 41.27 0.35 Allowed Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.809 -0.632 . . . . 2.28 111.914 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.671 ' HD3' ' N ' ' A' ' 6' ' ' MET . 4.9 Cg_endo -87.48 14.95 2.26 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.521 2.147 . . . . 0.92 112.966 -175.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.541 ' HB3' ' HB2' ' A' ' 12' ' ' GLN . 38.3 mt-10 -135.56 -15.08 1.89 Allowed 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.233 -0.654 . . . . 1.2 109.233 165.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' HB ' ' HB2' ' A' ' 6' ' ' MET . 59.2 t -62.48 -31.24 51.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.409 -0.814 . . . . 0.61 109.315 171.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 -101.53 -50.26 3.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.229 0.538 . . . . 2.74 110.069 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.789 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.8 m-85 -61.48 -54.79 38.66 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.744 -0.662 . . . . 0.56 111.845 -172.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 32.2 tt0 -59.72 -40.84 89.33 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.529 0.204 . . . . 1.26 111.197 -170.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -62.04 -48.0 82.21 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.499 0.666 . . . . 1.19 110.009 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.738 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.7 OUTLIER -66.45 -26.25 67.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.154 -0.93 . . . . 1.24 111.008 177.044 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.867 HD11 ' HB3' ' A' ' 30' ' ' LEU . 36.6 mt -73.35 -35.17 65.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.2 111.313 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 27.3 mt-10 -73.03 -27.15 61.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.558 0.694 . . . . 0.88 109.567 174.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 21' ' ' MET . 45.7 tt0 -65.09 -52.77 53.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.209 -0.905 . . . . 0.37 109.931 173.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.682 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 73.1 mt -62.49 -38.25 89.14 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.837 0.827 . . . . 0.17 108.982 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.3 t30 -49.87 -36.65 27.93 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.927 -1.488 . . . . 0.25 110.575 176.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 t -86.36 -19.3 29.97 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.949 -1.023 . . . . 0.66 110.227 -177.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.682 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 24.6 mmm -73.99 -19.97 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.122 -0.945 . . . . 1.41 110.016 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.24 15.63 15.44 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 110.57 -1.012 . . . . 0.19 110.57 -172.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 65.8 m-85 -113.65 107.2 15.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.075 0.464 . . . . 0.37 110.206 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.476 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -124.84 8.9 4.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.898 -0.592 . . . . 0.23 110.847 -174.821 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.59 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -76.12 79.68 2.94 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.242 -1.392 . . . . 1.84 107.242 172.143 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.73 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -46.73 -45.83 19.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 123.66 0.6 . . . . 1.63 111.193 -173.235 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 31' ' ' GLN . 2.3 mp0 -55.68 -46.98 77.48 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.858 0.724 . . . . 2.44 110.442 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.59 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -70.39 -44.32 68.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.338 -0.392 . . . . 0.26 110.269 -179.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.668 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.2 m-20 -54.0 -64.16 0.92 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.551 -0.75 . . . . 0.14 111.089 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.9 OUTLIER -73.56 -25.32 60.32 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.287 -0.565 . . . . 0.27 111.794 -172.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 27' ' ' GLU . 7.0 mm-40 -66.76 -28.56 68.5 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 118.542 0.61 . . . . 2.18 110.109 175.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.84 -32.9 62.05 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.928 -1.138 . . . . 0.12 107.928 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 11' ' ' PHE . 2.1 mp -76.82 -20.52 56.26 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.82 -1.082 . . . . 0.2 111.286 174.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 30' ' ' LEU . 23.9 mt -73.89 -38.99 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.129 -0.693 . . . . 0.34 109.129 176.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.81 -21.34 47.88 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.26 -0.882 . . . . 0.23 111.471 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 43.6 p -103.78 -18.74 14.55 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.922 0.391 . . . . 0.17 111.808 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.18 29.96 68.01 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.29 113.67 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.74 20.84 10.26 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.085 -1.055 . . . . 0.37 111.969 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.516 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 10.7 t0 -104.1 89.63 3.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.837 -1.542 . . . . 0.64 106.837 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.23 -26.14 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 114.414 -1.267 . . . . 0.52 111.597 -168.835 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -50.02 71.49 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.668 -0.864 . . . . 1.29 108.668 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.09 -33.06 73.83 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.098 -0.956 . . . . 0.29 110.55 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.45 -49.27 67.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.676 -0.238 . . . . 0.24 111.017 172.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.809 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -65.01 -39.92 87.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 N-CA-C 109.919 -0.4 . . . . 0.38 109.919 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.0 -24.43 67.03 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.007 -0.542 . . . . 2.35 110.858 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 52.7 mtt180 -83.05 -33.37 26.46 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.862 -0.335 . . . . 2.47 110.855 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.35 -38.32 78.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.916 0.389 . . . . 0.45 111.144 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.517 HD23 HG22 ' A' ' 44' ' ' ILE . 3.5 mm? -88.86 -37.67 15.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.027 0.442 . . . . 1.76 110.707 176.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.17 -46.29 7.08 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.59 -0.814 . . . . 1.28 113.282 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.7 m -97.11 77.11 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.02 0.438 . . . . 4.31 110.501 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -111.25 85.13 2.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 122.094 0.949 . . . . 5.65 109.01 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -108.96 81.87 1.51 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.874 -1.057 . . . . 9.0 109.946 -175.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-N 115.037 -0.983 . . . . 10.04 110.576 -178.643 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 111.643 -0.583 . . . . 6.75 111.643 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.24 159.13 36.47 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.874 2.382 . . . . 6.37 111.72 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.7 mt -98.06 117.01 31.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.063 0.459 . . . . 4.58 111.233 -177.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.43 -11.94 65.69 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.668 -0.696 . . . . 1.5 111.438 172.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 m -88.07 48.44 1.64 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.798 0.809 . . . . 1.68 109.273 175.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 43.9 mtm -145.63 63.93 9.97 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 107.379 -1.341 . . . . 2.28 107.379 173.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -52.68 -38.71 77.04 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 123.253 2.635 . . . . 0.92 113.742 -168.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 26.8 mt-10 -85.97 3.9 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.527 -0.469 . . . . 1.2 112.157 -174.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.8 t -81.89 -25.41 9.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.968 -0.753 . . . . 0.61 108.968 170.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -100.78 -54.49 2.81 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.763 0.792 . . . . 2.74 109.13 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.661 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.5 m-30 -61.97 -55.47 29.04 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 114.81 -1.086 . . . . 0.56 111.462 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.547 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.5 tt0 -59.8 -33.28 71.52 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.836 -0.346 . . . . 1.26 111.642 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -62.83 -48.87 77.19 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.702 0.763 . . . . 1.19 109.403 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.508 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -68.89 -21.09 64.26 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.091 -0.959 . . . . 1.24 111.022 174.926 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.859 HD22 ' HB3' ' A' ' 29' ' ' ASN . 13.6 mt -74.37 -30.78 62.12 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 110.161 -0.311 . . . . 0.2 110.161 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.639 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 31.3 mt-10 -72.31 -30.0 64.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.886 0.85 . . . . 0.88 109.324 172.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 21' ' ' MET . 52.5 tt0 -66.44 -48.56 69.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.272 -0.876 . . . . 0.37 110.198 174.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.879 ' HG ' HD11 ' A' ' 40' ' ' ILE . 71.8 mt -68.73 -31.49 70.59 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.941 -0.763 . . . . 0.17 108.941 177.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.639 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 8.6 t30 -50.22 -37.21 34.35 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.202 -1.363 . . . . 0.25 109.817 173.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -86.68 -4.52 59.19 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.31 -1.314 . . . . 0.66 110.67 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.747 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 30.6 mtt -96.12 -9.2 31.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.542 0.687 . . . . 1.41 109.223 178.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.2 15.99 36.65 Favored Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.008 -0.996 . . . . 0.19 111.369 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.477 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 34.6 m-85 -108.84 110.64 22.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.411 0.624 . . . . 0.37 110.032 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.57 1.83 4.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 115.291 -0.868 . . . . 0.23 111.285 -174.549 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -72.05 78.05 0.93 Allowed 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.368 -1.345 . . . . 1.84 107.368 165.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 15.9 mmt85 -47.45 -35.3 8.36 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.964 -1.017 . . . . 1.63 109.95 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 35.9 mt-10 -53.31 -61.99 1.94 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.033 -0.985 . . . . 2.44 111.71 173.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.0 73.19 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.064 -0.254 . . . . 0.26 110.598 -174.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.859 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.3 m-20 -49.67 -64.3 0.85 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.036 -0.529 . . . . 0.14 110.639 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.8 pp -74.74 -24.81 58.77 Favored 'General case' 0 C--O 1.212 -0.918 0 C-N-CA 119.852 -0.739 . . . . 0.27 112.323 -173.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.542 ' N ' HD12 ' A' ' 30' ' ' LEU . 80.3 mm-40 -61.25 -34.78 75.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.683 0.754 . . . . 2.18 109.406 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.71 -33.5 64.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.503 -1.226 . . . . 0.12 108.784 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.764 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -76.56 -20.76 56.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.326 -0.852 . . . . 0.2 110.975 175.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.755 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.4 mt -70.12 -41.25 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 109.118 -0.697 . . . . 0.34 109.118 174.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.93 -33.48 70.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.386 -0.825 . . . . 0.23 111.267 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.747 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 80.7 p -96.12 -18.81 19.86 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.956 0.354 . . . . 0.17 111.956 -177.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.68 33.02 56.59 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.29 112.717 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.764 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.45 10.8 56.59 Favored Glycine 0 CA--C 1.499 -0.951 0 C-N-CA 120.476 -0.869 . . . . 0.37 111.229 176.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.747 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.8 t70 -87.66 88.66 7.73 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 106.43 -1.693 . . . . 0.64 106.43 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.879 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -70.86 -22.4 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.025 -0.989 . . . . 0.52 111.738 -166.636 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.99 -51.41 66.94 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.611 -0.885 . . . . 1.29 108.611 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -65.8 -34.1 77.38 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.725 -1.125 . . . . 0.29 109.95 177.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 40' ' ' ILE . . . -58.75 -48.86 79.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.266 -0.424 . . . . 0.24 111.496 176.088 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.828 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.0 mt -62.9 -45.77 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 N-CA-C 109.96 -0.385 . . . . 0.38 109.96 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HG2' ' HA ' ' A' ' 42' ' ' ALA . 9.3 pt-20 -69.26 -19.41 63.92 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.495 -0.482 . . . . 2.35 110.593 -177.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 48.0 mtt180 -78.17 -35.8 48.31 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 120.58 -0.448 . . . . 2.47 109.981 173.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.81 -50.31 67.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.45 110.71 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.35 -38.23 50.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.229 -0.441 . . . . 1.76 110.688 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.27 -51.3 7.57 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.747 -0.74 . . . . 1.28 112.872 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.9 m -119.27 70.31 0.84 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.086 0.47 . . . . 4.31 110.151 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.407 ' HG2' ' H ' ' A' ' 51' ' ' GLN . 7.9 pt20 -79.84 84.9 5.56 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.231 -1.026 . . . . 5.65 108.231 172.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -106.11 83.66 1.93 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.925 -1.034 . . . . 9.0 110.883 -170.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 0.993 0 CA-C-N 115.156 -0.929 . . . . 10.04 109.59 178.35 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 N-CA-C 111.694 -0.563 . . . . 6.75 111.694 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.74 112.34 2.63 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.728 2.285 . . . . 6.37 111.929 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.454 ' O ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -60.55 110.4 1.27 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.831 0.824 . . . . 4.58 111.458 178.15 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.38 -34.25 4.4 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.383 -0.826 . . . . 1.5 112.616 176.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 64.4 m -85.58 52.35 2.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.484 0.659 . . . . 1.68 110.591 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.608 ' HE2' HG11 ' A' ' 9' ' ' VAL . 14.3 ptm -151.35 56.32 1.94 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-N 115.356 -0.838 . . . . 2.28 109.112 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 6' ' ' MET . 16.3 Cg_exo -68.14 -43.03 5.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.942 2.428 . . . . 0.92 112.056 -170.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.739 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 40.9 tt0 -70.28 -20.03 63.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 1.2 110.057 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.608 HG11 ' HE2' ' A' ' 6' ' ' MET . 70.9 t -65.4 -32.25 57.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.896 -0.593 . . . . 0.61 110.161 174.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -90.16 -39.14 13.02 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.723 -0.843 . . . . 2.74 108.723 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.739 ' HB2' ' HA ' ' A' ' 8' ' ' GLU . 9.7 m-30 -61.2 -50.74 71.88 Favored 'General case' 0 C--O 1.214 -0.801 0 CA-C-N 114.515 -1.22 . . . . 0.56 109.92 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.0 tt0 -56.01 -39.46 71.95 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 123.207 0.317 . . . . 1.26 111.389 -177.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -63.37 -44.86 93.58 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.671 0.748 . . . . 1.19 109.502 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.672 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.0 OUTLIER -73.66 -19.28 60.88 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.189 -0.914 . . . . 1.24 111.216 175.166 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.9 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.6 mt -77.88 -36.24 49.94 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 110.04 -0.355 . . . . 0.2 110.04 -178.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 29.0 mt-10 -70.79 -29.02 65.1 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.77 0.669 . . . . 0.88 109.64 172.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -66.28 -51.7 54.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.37 110.045 174.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.872 ' HG ' HD11 ' A' ' 40' ' ' ILE . 79.5 mt -63.61 -34.74 78.5 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.938 0.875 . . . . 0.17 108.885 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.625 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.2 t30 -53.19 -34.87 58.81 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.902 -1.499 . . . . 0.25 110.266 175.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.4 t -86.8 -12.01 49.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.625 -1.17 . . . . 0.66 110.01 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.9 mmm -90.86 -5.55 55.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.266 -0.879 . . . . 1.41 109.892 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.17 15.99 39.61 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.323 -0.853 . . . . 0.19 111.195 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.503 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.4 m-85 -111.42 107.41 16.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.135 0.493 . . . . 0.37 109.771 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.485 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -127.29 8.44 3.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.802 -0.635 . . . . 0.23 111.322 -173.622 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.96 85.7 7.1 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 106.423 -1.695 . . . . 1.84 106.423 170.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.836 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.2 mmp_? -42.81 -47.52 5.53 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.069 0.856 . . . . 1.63 110.555 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -44.39 -57.1 3.73 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.587 1.18 . . . . 2.44 111.275 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.09 64.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.888 0.375 . . . . 0.26 110.347 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.804 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.7 -65.03 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.162 -0.926 . . . . 0.14 111.556 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.9 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.7 pp -73.15 -28.11 62.05 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 119.126 -0.464 . . . . 0.27 111.969 -172.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.56 ' N ' HD12 ' A' ' 30' ' ' LEU . 46.9 mt-30 -60.09 -37.02 78.71 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.731 0.776 . . . . 2.18 109.678 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -72.17 -31.67 66.14 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.363 -1.29 . . . . 0.12 108.814 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.768 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -79.33 -19.59 49.98 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.218 -0.901 . . . . 0.2 111.17 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.1 mt -71.09 -44.18 75.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.777 -0.823 . . . . 0.34 108.777 173.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.97 -27.21 66.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.202 -0.908 . . . . 0.23 111.287 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.832 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 54.7 p -101.73 -19.38 15.4 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.53 0.567 . . . . 0.17 112.53 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.52 26.12 72.53 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.06 -0.59 . . . . 0.29 112.201 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.768 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 98.44 18.76 25.07 Favored Glycine 0 CA--C 1.5 -0.855 0 C-N-CA 120.66 -0.781 . . . . 0.37 111.472 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.832 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 18.4 t70 -94.04 87.87 5.48 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.395 -1.705 . . . . 0.64 106.395 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.872 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -68.94 -23.92 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 114.849 -1.068 . . . . 0.52 110.923 -166.735 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 60.3 m-20 -52.51 -57.39 10.07 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.25 0.548 . . . . 1.29 109.717 173.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' A' ' 45' ' ' GLU . . . -72.55 -22.32 61.03 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.319 -0.855 . . . . 0.29 111.09 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.445 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -58.23 -48.63 79.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 121.162 -0.215 . . . . 0.24 110.585 168.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.449 HD13 ' CE ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -70.74 -32.98 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 120.544 -0.462 . . . . 0.38 110.753 177.873 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 6.9 mm-40 -61.61 -22.72 65.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.087 0.47 . . . . 2.35 110.098 174.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -88.76 -44.59 10.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.954 -0.566 . . . . 2.47 111.195 175.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt -62.66 -37.84 87.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.855 0.359 . . . . 0.45 111.678 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 48' ' ' LEU . 3.6 mm? -96.03 -35.89 11.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.129 -0.487 . . . . 1.76 111.149 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.46 -45.87 5.69 Favored Glycine 0 CA--C 1.51 -0.261 0 C-N-CA 120.39 -0.91 . . . . 1.28 112.494 -174.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.2 m -95.56 75.33 3.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.424 0.631 . . . . 4.31 110.086 -178.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -106.89 85.14 2.09 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 121.949 0.88 . . . . 5.65 108.67 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.6 81.57 1.92 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.873 -1.058 . . . . 9.0 110.541 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.001 -0.999 . . . . 10.04 108.974 175.924 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.68 0 N-CA-C 111.589 -0.604 . . . . 6.75 111.589 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.74 146.13 26.37 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.786 2.324 . . . . 6.37 111.04 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 1.4 pt? -121.25 112.54 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.363 0.601 . . . . 4.58 110.664 -178.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.54 4.56 72.75 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.284 -0.871 . . . . 1.5 111.841 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.8 m -85.73 47.35 1.43 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 122.119 0.962 . . . . 1.68 109.447 178.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.427 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 33.0 mtm -146.26 59.23 5.23 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 106.848 -1.538 . . . . 2.28 106.848 173.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.54 -38.97 90.27 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.95 2.433 . . . . 0.92 112.766 -166.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.946 ' HG2' ' HB2' ' A' ' 12' ' ' GLN . 4.7 tt0 -82.06 -9.0 59.69 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.651 -0.42 . . . . 1.2 110.97 -172.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.427 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 87.9 t -69.43 -29.66 42.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.424 0.63 . . . . 0.61 109.512 174.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -92.83 -49.51 6.02 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.76 -0.83 . . . . 2.74 108.76 173.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.786 ' HA ' HD22 ' A' ' 33' ' ' LEU . 17.7 m-30 -62.55 -55.28 28.78 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 114.937 -1.029 . . . . 0.56 111.968 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.946 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 50.8 tt0 -56.97 -42.43 80.16 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.778 0.288 . . . . 1.26 111.778 -172.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -60.17 -45.75 92.01 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.649 0.737 . . . . 1.19 110.181 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.724 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -72.77 -21.0 61.07 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.892 -1.049 . . . . 1.24 111.444 176.348 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.854 HD22 ' HB3' ' A' ' 29' ' ' ASN . 11.8 mt -73.73 -37.6 65.06 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.267 -0.271 . . . . 0.2 110.267 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 29.8 mt-10 -69.68 -28.7 66.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.721 0.772 . . . . 0.88 109.376 174.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.8 tt0 -67.51 -46.33 73.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.407 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.541 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 42.6 mt -67.56 -31.9 72.29 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.082 0.944 . . . . 0.17 108.914 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.558 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.3 t30 -57.07 -30.5 64.34 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 113.633 -1.621 . . . . 0.25 109.966 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -83.11 -19.8 36.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.478 -1.237 . . . . 0.66 109.9 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 13.3 mmt -80.18 -17.55 52.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.135 -0.939 . . . . 1.41 109.889 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.25 13.45 28.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.391 -1.083 . . . . 0.19 110.391 -171.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.6 m-85 -105.14 108.89 20.65 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.298 0.57 . . . . 0.37 110.856 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -125.33 13.02 4.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.627 -0.715 . . . . 0.23 111.367 -174.837 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 1.8 t-20 -84.99 80.25 9.36 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 106.736 -1.579 . . . . 1.84 106.736 173.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.771 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.1 mmp_? -43.18 -49.23 6.53 Favored 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.934 0.771 . . . . 1.63 111.322 -174.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -47.73 -55.93 8.46 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 124.602 1.189 . . . . 2.44 110.537 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.542 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -66.75 -46.91 73.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.144 -0.48 . . . . 0.26 110.744 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.854 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.05 -64.23 0.85 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.641 -0.709 . . . . 0.14 111.31 177.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.6 pp -71.84 -27.31 62.81 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 120.376 -0.53 . . . . 0.27 111.976 -174.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.504 ' N ' HD12 ' A' ' 30' ' ' LEU . 16.6 mm-40 -65.03 -30.85 71.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.348 0.594 . . . . 2.18 109.93 176.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.88 -32.89 61.98 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.574 -0.899 . . . . 0.12 108.574 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.9 mp -73.95 -23.7 59.54 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.21 -0.905 . . . . 0.2 111.334 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.4 mt -72.18 -37.55 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.278 -0.638 . . . . 0.34 109.278 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.8 -27.5 60.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.723 -0.671 . . . . 0.23 111.305 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.672 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 66.0 p -99.95 -17.96 17.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.298 -0.41 . . . . 0.17 111.696 -177.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.99 29.77 70.5 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.29 113.056 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.03 22.0 10.44 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 119.979 -1.105 . . . . 0.37 111.48 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.672 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t0 -104.51 89.09 3.11 Favored 'General case' 0 CA--C 1.499 -1.011 0 N-CA-C 106.597 -1.631 . . . . 0.64 106.597 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.711 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -66.95 -25.14 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 CA-C-N 114.374 -1.285 . . . . 0.52 111.599 -168.316 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.18 -49.34 74.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.579 -0.897 . . . . 1.29 108.579 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.624 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -67.95 -33.43 74.64 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.851 -1.068 . . . . 0.29 110.077 177.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.49 67.65 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 111.376 0.139 . . . . 0.24 111.376 173.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -40.14 87.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 CA-C-O 120.744 0.306 . . . . 0.38 110.226 178.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -67.9 -19.62 65.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.233 -0.44 . . . . 2.35 110.585 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 57.3 mtp85 -77.79 -47.73 18.24 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.158 -0.617 . . . . 2.47 109.597 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.462 HD11 HD13 ' A' ' 18' ' ' LEU . 24.3 mt -70.07 -44.82 68.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.272 -0.876 . . . . 0.45 111.485 -177.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.35 18.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.313 -0.858 . . . . 1.76 110.369 -172.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -79.23 -57.17 3.24 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.248 -0.977 . . . . 1.28 111.983 -176.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.1 m -86.62 80.51 8.56 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.379 0.609 . . . . 4.31 109.42 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -110.93 84.8 1.99 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 122.25 1.024 . . . . 5.65 108.941 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 mp -106.47 85.86 2.25 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 114.817 -1.083 . . . . 9.0 110.108 -173.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.118 -0.944 . . . . 10.04 109.476 178.436 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.404 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 111.887 -0.485 . . . . 6.75 111.887 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.404 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 17.2 Cg_exo -67.8 156.39 66.16 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.133 2.556 . . . . 6.37 112.287 178.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 pp -120.58 126.6 50.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.076 -0.511 . . . . 4.58 110.367 178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.43 -33.83 2.04 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.687 -0.688 . . . . 1.5 113.245 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.8 m -80.0 55.28 2.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.637 0.732 . . . . 1.68 110.435 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.632 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 1.1 ppp? -153.32 46.22 0.32 Allowed Pre-proline 0 N--CA 1.439 -1.014 0 CA-C-N 114.894 -1.048 . . . . 2.28 108.874 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.632 ' HD3' ' N ' ' A' ' 6' ' ' MET . 16.0 Cg_exo -65.68 -47.47 3.95 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 122.15 1.9 . . . . 0.92 111.503 -171.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.693 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 20.7 mt-10 -73.69 -12.89 60.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.942 -0.572 . . . . 1.2 111.229 -178.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 6' ' ' MET . 87.1 t -63.08 -27.27 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.986 -0.746 . . . . 0.61 108.986 170.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -102.4 -47.94 4.32 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.663 0.744 . . . . 2.74 110.001 172.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.693 ' HB2' ' HA ' ' A' ' 8' ' ' GLU . 12.5 m-30 -62.39 -54.91 33.43 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 115.005 -0.998 . . . . 0.56 112.204 -174.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 tt0 -58.84 -36.87 75.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.197 -0.201 . . . . 1.26 111.049 -173.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -64.18 -41.46 97.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.813 0.816 . . . . 1.19 109.937 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.79 ' HB3' HG13 ' A' ' 40' ' ' ILE . 33.4 mt-30 -74.98 -21.12 59.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.118 -0.946 . . . . 1.24 110.931 175.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 30' ' ' LEU . 20.1 mt -75.46 -36.67 60.65 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.591 -0.277 . . . . 0.2 110.317 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.6 mt-10 -73.43 -26.02 60.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.499 0.666 . . . . 0.88 109.975 174.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -66.97 -50.87 60.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.267 -0.878 . . . . 0.37 109.723 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.852 ' HG ' HD11 ' A' ' 40' ' ' ILE . 33.0 mt -63.37 -34.71 78.31 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.9 0.857 . . . . 0.17 109.135 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 5.4 t30 -53.92 -34.93 60.99 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.031 -1.441 . . . . 0.25 110.275 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 t -87.23 -6.2 58.66 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.558 -1.201 . . . . 0.66 109.822 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.564 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 7.2 mmm -98.33 -4.72 34.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.966 -1.016 . . . . 1.41 109.864 -178.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.69 18.23 33.24 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.3 -0.864 . . . . 0.19 111.295 -177.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.513 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 60.8 m-85 -113.4 109.32 18.5 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.116 0.484 . . . . 0.37 109.764 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.529 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -126.98 0.88 3.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.054 -0.521 . . . . 0.23 111.596 -172.873 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.69 82.31 3.32 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.117 -1.438 . . . . 1.84 107.117 171.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.5 mmp_? -41.64 -49.0 4.19 Favored 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 124.011 0.819 . . . . 1.63 110.933 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 2.4 mm-40 -43.59 -58.57 2.58 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.729 1.268 . . . . 2.44 110.588 176.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.83 -49.23 63.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.26 110.723 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.797 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.1 m-20 -45.55 -64.25 0.77 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.745 0.653 . . . . 0.14 111.385 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.1 pp -72.99 -27.01 61.55 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-O 119.006 -0.521 . . . . 0.27 112.189 -173.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.509 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.9 mm100 -60.78 -35.33 76.16 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.711 0.767 . . . . 2.18 109.389 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.469 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -73.12 -33.16 65.38 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.563 -1.199 . . . . 0.12 108.718 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.62 HD21 ' CB ' ' A' ' 14' ' ' GLN . 2.3 mp -75.84 -25.61 56.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.164 -0.926 . . . . 0.2 111.387 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 30' ' ' LEU . 5.3 mt -73.99 -32.71 34.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.394 0.616 . . . . 0.34 109.391 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.624 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -79.55 -23.54 42.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.455 -0.793 . . . . 0.23 111.139 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 45.7 p -104.79 -17.98 14.41 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.214 0.45 . . . . 0.17 112.214 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.72 32.21 70.61 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 121.408 -0.425 . . . . 0.29 113.051 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.93 37.88 5.06 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 119.884 -1.15 . . . . 0.37 111.43 176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.458 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t70 -119.38 87.11 2.68 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 106.119 -1.808 . . . . 0.64 106.119 172.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.868 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -65.55 -24.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.557 0 CA-C-N 113.836 -1.529 . . . . 0.52 111.644 -166.597 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -62.03 -50.44 72.01 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.938 -0.764 . . . . 1.29 108.938 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.584 ' O ' ' HG3' ' A' ' 45' ' ' GLU . . . -68.88 -32.13 71.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.876 -1.056 . . . . 0.29 110.367 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.523 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -56.14 -49.85 72.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 121.26 -0.176 . . . . 0.24 110.882 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.868 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.6 mt -63.29 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.699 0.285 . . . . 0.38 110.812 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.584 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -72.99 -19.6 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.745 -0.382 . . . . 2.35 110.585 -176.3 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.624 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 75.3 mtt180 -84.85 -27.11 26.95 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.974 0.416 . . . . 2.47 110.409 173.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 96.2 mt -70.14 -44.22 69.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 0.45 110.071 174.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.45 -35.86 80.04 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.315 -0.857 . . . . 1.76 109.318 170.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.83 71.96 0.96 Allowed Glycine 0 CA--C 1.496 -1.11 0 N-CA-C 110.603 -0.999 . . . . 1.28 110.603 -177.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.1 m -32.53 100.34 0.02 OUTLIER 'General case' 0 C--O 1.233 0.186 0 O-C-N 125.11 1.124 . . . . 4.31 112.403 -177.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -110.98 89.55 3.08 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.661 -1.154 . . . . 5.65 108.971 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.25 92.32 3.72 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.243 -0.89 . . . . 9.0 110.627 -174.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.254 1.335 0 CA-C-N 113.944 -1.48 . . . . 10.04 110.286 177.14 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.406 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.943 -0.463 . . . . 6.75 111.943 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 3.8 Cg_exo -79.16 160.44 26.54 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 6.37 111.772 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.2 mt -76.94 100.29 5.53 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.996 -0.547 . . . . 4.58 111.207 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.69 -2.56 22.54 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.697 -0.763 . . . . 1.5 111.45 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.7 m -84.67 50.81 1.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.717 0.77 . . . . 1.68 110.062 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.512 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 25.2 mtm -145.75 56.59 3.51 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.176 -0.92 . . . . 2.28 108.894 177.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 6' ' ' MET . 34.9 Cg_exo -60.13 -36.83 87.45 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.251 1.968 . . . . 0.92 112.229 -170.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 29.8 mt-10 -82.99 -11.53 58.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.2 111.315 -176.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.512 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 98.4 t -75.3 -21.03 16.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.654 0.74 . . . . 0.61 109.422 174.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -102.78 -55.81 2.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.581 0.705 . . . . 2.74 109.156 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.806 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.2 m-30 -61.54 -54.6 40.93 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.849 -1.069 . . . . 0.56 111.375 -172.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.616 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 63.2 tt0 -59.54 -34.34 72.52 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 121.235 -0.186 . . . . 1.26 111.492 -172.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -65.02 -47.42 77.5 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.578 0.704 . . . . 1.19 109.427 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.752 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.1 mp0 -69.6 -19.28 63.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.282 -0.872 . . . . 1.24 111.203 174.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.641 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.5 mt -73.75 -40.2 63.67 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.621 -0.511 . . . . 0.2 109.621 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 33.3 mt-10 -64.54 -31.35 72.53 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.827 0.822 . . . . 0.88 109.59 173.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.497 ' O ' ' HG2' ' A' ' 21' ' ' MET . 44.6 tt0 -66.83 -50.63 61.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.096 -0.956 . . . . 0.37 111.056 175.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.681 ' HG ' HD11 ' A' ' 40' ' ' ILE . 62.0 mt -66.37 -30.15 70.47 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.854 0.835 . . . . 0.17 108.871 177.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.9 t30 -54.23 -35.29 62.3 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.051 -1.431 . . . . 0.25 110.3 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 t -87.1 -3.74 59.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.727 -1.124 . . . . 0.66 110.027 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.619 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 31.6 mmm -97.48 -8.38 29.38 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.306 -0.861 . . . . 1.41 109.718 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.28 16.89 33.39 Favored Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.27 -0.877 . . . . 0.19 111.153 -176.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.52 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.3 m-85 -110.63 109.52 19.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.37 109.879 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.76 -8.06 10.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.764 -0.653 . . . . 0.23 111.43 -172.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -73.13 83.14 1.3 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.94 -1.504 . . . . 1.84 106.94 169.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.89 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 57.2 mtt85 -60.98 -26.01 67.26 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.218 -0.446 . . . . 1.63 110.717 -175.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -52.76 -50.5 63.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.433 -0.58 . . . . 2.44 109.433 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.52 -46.26 60.14 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.987 -0.551 . . . . 0.26 110.421 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' CB ' HD22 ' A' ' 15' ' ' LEU . 6.6 m-20 -50.82 -60.41 3.09 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.659 -0.701 . . . . 0.14 111.268 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.89 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 2.0 pp -73.87 -24.22 59.71 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 120.294 -0.563 . . . . 0.27 112.343 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.546 ' N ' HD12 ' A' ' 30' ' ' LEU . 11.0 mm100 -60.85 -34.66 74.93 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.88 0.848 . . . . 2.18 109.328 172.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -31.17 61.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.285 -1.325 . . . . 0.12 108.176 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.806 HD22 ' HA ' ' A' ' 11' ' ' PHE . 0.9 OUTLIER -79.68 -22.06 43.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.166 -0.925 . . . . 0.2 111.233 177.289 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.752 HG13 ' O ' ' A' ' 30' ' ' LEU . 6.0 mt -73.33 -38.5 53.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.641 -0.503 . . . . 0.34 109.641 175.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.6 -22.16 54.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.852 -0.613 . . . . 0.23 111.152 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.476 ' OG1' ' HA ' ' A' ' 33' ' ' LEU . 46.4 p -102.86 -18.78 14.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.338 0.496 . . . . 0.17 112.338 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.93 28.86 59.94 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 121.343 -0.456 . . . . 0.29 113.241 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.748 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 103.07 10.17 37.54 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.103 -1.046 . . . . 0.37 111.487 176.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.474 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.3 t70 -96.52 87.88 4.53 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 107.117 -1.438 . . . . 0.64 107.117 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.8 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -64.59 -25.72 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-N 114.11 -1.404 . . . . 0.52 111.536 -169.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 5.5 m-80 -60.51 -53.91 51.8 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.829 -0.804 . . . . 1.29 108.829 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.26 -30.9 70.04 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.437 -0.801 . . . . 0.29 110.559 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -46.32 74.0 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.395 -0.366 . . . . 0.24 110.543 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.8 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -68.13 -37.53 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.892 -0.41 . . . . 0.38 109.892 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 41' ' ' ASN . 51.0 mt-10 -65.7 -21.12 66.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.93 -0.577 . . . . 2.35 110.935 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 54.1 mtt180 -87.33 -40.95 14.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.312 -0.404 . . . . 2.47 110.845 176.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -47.57 85.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.995 0.426 . . . . 0.45 110.685 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.466 HD23 HG22 ' A' ' 44' ' ' ILE . 4.3 mm? -72.66 -32.41 65.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.929 -0.578 . . . . 1.76 109.842 173.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 68.14 72.27 0.84 Allowed Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.737 -0.945 . . . . 1.28 110.737 -178.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.2 m -35.13 99.21 0.02 OUTLIER 'General case' 0 C--O 1.233 0.206 0 O-C-N 125.189 1.17 . . . . 4.31 111.89 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -109.6 86.56 2.32 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.797 -1.092 . . . . 5.65 109.249 -177.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mp -124.18 84.77 2.32 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.011 -0.995 . . . . 9.0 109.626 -176.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.481 -0.781 . . . . 10.04 110.028 -175.632 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 111.648 -0.581 . . . . 6.75 111.648 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -78.24 126.37 7.67 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.364 2.043 . . . . 6.37 112.779 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -111.35 110.09 20.39 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.499 0.666 . . . . 4.58 109.33 174.155 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -121.11 -16.79 4.26 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.457 -0.878 . . . . 1.5 111.945 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 m -115.1 51.17 0.93 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.536 0.684 . . . . 1.68 110.544 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.592 ' HE2' HG11 ' A' ' 9' ' ' VAL . 73.7 mtp -138.37 56.34 10.06 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 2.28 108.691 172.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 6' ' ' MET . 35.5 Cg_exo -60.87 -57.39 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.827 2.351 . . . . 0.92 112.451 -168.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.74 ' HG2' ' HB2' ' A' ' 12' ' ' GLN . 21.7 tt0 -82.31 1.81 35.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.393 0.616 . . . . 1.2 110.215 -170.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.592 HG11 ' HE2' ' A' ' 6' ' ' MET . 93.3 t -78.65 -31.85 15.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.582 -0.735 . . . . 0.61 109.217 173.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -101.65 -39.85 7.27 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.682 -0.69 . . . . 2.74 110.151 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.651 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 17.2 m-30 -61.44 -54.55 42.02 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 115.238 -0.892 . . . . 0.56 110.318 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.74 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 48.1 tt0 -55.78 -35.56 66.39 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 123.368 0.417 . . . . 1.26 111.51 -175.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -64.56 -49.65 70.38 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.566 0.698 . . . . 1.19 109.267 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.506 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -68.75 -19.04 64.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.147 -0.933 . . . . 1.24 111.038 174.378 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.3 mt -75.97 -35.85 59.49 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 122.027 -0.42 . . . . 0.2 110.083 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 30.7 mt-10 -71.93 -25.6 61.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.538 0.685 . . . . 0.88 109.362 173.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -70.01 -46.28 65.44 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.444 -0.798 . . . . 0.37 110.569 174.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.886 ' HG ' HD11 ' A' ' 40' ' ' ILE . 63.7 mt -69.47 -33.56 73.08 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.281 -1.007 . . . . 0.17 108.281 177.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 6.1 t30 -51.8 -35.01 42.58 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.482 -1.69 . . . . 0.25 110.146 173.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.6 t -86.57 -11.1 52.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.592 -1.186 . . . . 0.66 110.378 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.651 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.2 mmm -90.45 -13.26 35.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.716 -0.675 . . . . 1.41 110.204 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.02 13.32 27.49 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-N 115.386 -0.825 . . . . 0.19 111.349 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.423 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m-85 -111.12 107.96 17.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.244 0.545 . . . . 0.37 110.392 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.49 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -123.79 6.22 5.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.94 -0.573 . . . . 0.23 111.37 -174.526 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.9 79.16 2.8 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.383 -1.339 . . . . 1.84 107.383 167.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.795 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 9.0 mmt85 -46.36 -39.48 10.4 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.574 -0.739 . . . . 1.63 109.926 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -46.94 -62.19 1.52 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.649 -1.16 . . . . 2.44 111.429 172.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.77 -39.69 66.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.802 -0.359 . . . . 0.26 110.76 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.786 ' HB3' HD22 ' A' ' 15' ' ' LEU . 7.3 m-20 -49.34 -64.95 0.66 Allowed 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 123.284 0.365 . . . . 0.14 111.082 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.895 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.3 pp -74.98 -26.53 59.64 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 119.835 -0.746 . . . . 0.27 112.364 -171.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.595 ' N ' HD12 ' A' ' 30' ' ' LEU . 88.8 mt-30 -63.65 -33.3 75.32 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.763 0.792 . . . . 2.18 109.661 176.152 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.45 67.23 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.499 -1.228 . . . . 0.12 108.541 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.745 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -74.78 -23.24 58.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.316 -0.857 . . . . 0.2 110.935 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.773 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.6 mt -70.72 -36.85 66.75 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.649 0.738 . . . . 0.34 109.246 175.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.593 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -78.65 -20.52 50.08 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.055 -0.975 . . . . 0.23 111.501 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 63.3 p -108.36 -19.1 13.58 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.852 -0.339 . . . . 0.17 111.817 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.8 26.46 58.54 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 121.473 -0.394 . . . . 0.29 112.908 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.745 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 97.69 16.87 32.47 Favored Glycine 0 CA--C 1.497 -1.059 0 C-N-CA 120.2 -1.0 . . . . 0.37 111.311 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.621 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.0 t70 -93.13 93.06 8.08 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 105.405 -2.072 . . . . 0.64 105.405 170.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.886 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.77 -25.05 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-N 114.862 -1.063 . . . . 0.52 111.355 -166.798 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -59.52 -52.03 67.29 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.295 -0.631 . . . . 1.29 109.295 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' GLU . . . -69.8 -27.18 64.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.318 -0.855 . . . . 0.29 110.288 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.497 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -61.65 -49.2 77.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.24 110.859 173.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.83 HG13 ' O ' ' A' ' 40' ' ' ILE . 2.6 mt -65.88 -38.63 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 120.685 0.278 . . . . 0.38 110.264 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 42' ' ' ALA . 6.4 pt-20 -66.71 -24.24 66.22 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.905 -0.318 . . . . 2.35 110.487 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.593 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 61.0 mtt180 -82.17 -29.67 31.41 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.626 -0.43 . . . . 2.47 110.091 175.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 44' ' ' ILE . 91.4 mt -66.14 -49.09 68.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.263 -0.426 . . . . 0.45 110.808 177.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -83.47 -34.93 25.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.092 0.472 . . . . 1.76 110.679 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -72.56 -45.34 36.95 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.468 -0.787 . . . . 1.28 113.07 -174.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.5 m -85.36 74.58 10.36 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.373 0.606 . . . . 4.31 109.977 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -107.94 86.03 2.22 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.758 0.789 . . . . 5.65 109.156 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -119.58 85.18 2.33 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.307 -0.86 . . . . 9.0 110.217 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.246 0.913 0 CA-C-N 114.85 -1.068 . . . . 10.04 108.918 177.863 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 N-CA-C 111.804 -0.518 . . . . 6.75 111.804 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -63.5 166.65 14.84 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.851 2.367 . . . . 6.37 112.366 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.433 HD22 ' SD ' ' A' ' 6' ' ' MET . 75.3 mt -81.79 98.97 8.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.996 -0.547 . . . . 4.58 111.625 -177.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.32 -8.79 1.28 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.234 -0.893 . . . . 1.5 111.014 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.9 m -89.76 49.83 1.79 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.811 0.815 . . . . 1.68 109.719 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.537 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 16.6 mtm -139.96 50.13 2.22 Favored Pre-proline 0 N--CA 1.448 -0.541 0 CA-C-N 114.853 -1.067 . . . . 2.28 109.379 177.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 6' ' ' MET . 37.8 Cg_exo -58.76 -41.72 60.42 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 121.817 1.678 . . . . 0.92 112.038 -171.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.412 ' HB3' ' HB2' ' A' ' 12' ' ' GLN . 28.7 mt-10 -83.47 -11.57 57.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.736 -0.386 . . . . 1.2 111.373 -175.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.463 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 81.2 t -67.42 -28.61 42.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.515 0.674 . . . . 0.61 109.297 173.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 -99.11 -56.66 2.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.684 -0.689 . . . . 2.74 109.793 172.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.731 ' HA ' HD22 ' A' ' 33' ' ' LEU . 18.3 m-30 -62.36 -55.21 30.23 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.308 -0.86 . . . . 0.56 111.679 -171.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.584 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 29.4 tt0 -58.68 -37.49 76.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 117.931 0.332 . . . . 1.26 110.979 -171.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -59.8 -52.07 67.04 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 122.212 1.006 . . . . 1.19 109.395 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.687 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -70.24 -20.04 63.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.182 -1.372 . . . . 1.24 111.365 178.289 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.0 mt -74.92 -35.09 62.2 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 122.348 -0.22 . . . . 0.2 110.652 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 34.3 mt-10 -70.68 -29.84 66.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.786 0.803 . . . . 0.88 109.18 173.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.402 ' HB3' ' O ' ' A' ' 14' ' ' GLN . 48.0 tt0 -66.28 -48.14 71.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.976 -1.011 . . . . 0.37 110.489 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.873 ' HG ' HD11 ' A' ' 40' ' ' ILE . 67.1 mt -69.59 -31.86 70.26 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.849 -0.797 . . . . 0.17 108.849 177.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.64 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.7 t30 -50.92 -34.35 28.12 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.181 -1.372 . . . . 0.25 110.062 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -86.71 -14.96 40.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.415 -1.266 . . . . 0.66 110.61 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 23.5 mtt -85.41 -10.76 55.78 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.488 0.661 . . . . 1.41 109.961 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.34 10.91 43.5 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 110.808 -0.917 . . . . 0.19 110.808 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.0 m-85 -107.73 109.32 20.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.582 0.706 . . . . 0.37 110.625 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.53 9.8 3.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 115.554 -0.748 . . . . 0.23 111.063 -174.257 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.585 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 1.7 t-20 -79.34 79.8 5.76 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 106.882 -1.525 . . . . 1.84 106.882 172.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.769 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 58.7 mmt-85 -46.04 -44.46 15.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.891 0.745 . . . . 1.63 111.948 -171.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.6 -49.98 75.67 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.514 0.508 . . . . 2.44 110.304 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -64.06 -47.77 78.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.18 -0.304 . . . . 0.26 110.18 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.773 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.5 m-20 -48.48 -63.46 1.08 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.656 -0.702 . . . . 0.14 111.036 176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.808 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.2 pp -73.8 -25.46 60.13 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 120.307 -0.557 . . . . 0.27 112.395 -172.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 30' ' ' LEU . 70.7 mt-30 -64.32 -32.48 74.1 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.753 0.787 . . . . 2.18 109.848 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -73.4 -33.46 64.99 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.861 -1.063 . . . . 0.12 108.591 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.8 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -75.19 -24.61 57.85 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.09 -0.959 . . . . 0.2 110.991 175.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.779 HG13 ' O ' ' A' ' 30' ' ' LEU . 26.4 mt -67.75 -48.29 76.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.363 -0.606 . . . . 0.34 109.363 175.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.4 -28.0 68.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.432 -0.804 . . . . 0.23 111.681 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.699 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 40.2 p -98.49 -18.76 18.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.865 0.364 . . . . 0.17 111.921 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.53 21.32 60.32 Favored Glycine 0 C--N 1.322 -0.23 0 C-N-CA 121.202 -0.523 . . . . 0.29 112.346 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.8 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.77 16.5 38.94 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 111.047 -0.821 . . . . 0.37 111.047 -178.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 19.7 t70 -90.89 87.73 6.75 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 106.041 -1.837 . . . . 0.64 106.041 175.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.873 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -73.54 -27.11 22.83 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.955 -1.02 . . . . 0.52 113.02 -158.495 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 8.8 p30 -60.97 -43.25 99.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.91 -0.774 . . . . 1.29 108.91 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -72.69 -30.6 64.36 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.022 -0.99 . . . . 0.29 110.639 176.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.52 91.53 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.468 -0.333 . . . . 0.24 110.83 172.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.1 mt -65.98 -38.71 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 N-CA-C 109.356 -0.609 . . . . 0.38 109.356 176.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 21.5 mm-40 -58.19 -30.39 66.39 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.505 -0.77 . . . . 2.35 110.41 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.3 mtp85 -77.96 -43.73 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.687 0.28 . . . . 2.47 110.742 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.76 -45.09 91.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 0.45 111.493 -177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.572 HD23 HG22 ' A' ' 44' ' ' ILE . 3.0 mm? -72.18 -35.62 69.04 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.359 -0.608 . . . . 1.76 109.359 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' ' 51' ' ' GLN . . . 73.68 74.84 0.79 Allowed Glycine 0 CA--C 1.491 -1.459 0 N-CA-C 109.944 -1.263 . . . . 1.28 109.944 -173.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 p -28.09 97.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 O-C-N 125.52 1.365 . . . . 4.31 112.198 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 45.3 mt-30 -101.73 86.25 2.89 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.828 -1.078 . . . . 5.65 108.238 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.559 ' H ' HD23 ' A' ' 52' ' ' LEU . 1.8 pt? -114.75 73.74 0.84 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.056 -0.974 . . . . 9.0 110.049 -173.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.249 1.067 0 CA-C-N 114.585 -1.188 . . . . 10.04 108.806 178.055 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 111.732 -0.547 . . . . 6.75 111.732 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -66.99 133.92 32.67 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.429 2.086 . . . . 6.37 111.729 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 3' ' ' LEU . 4.7 mp -82.24 100.6 9.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.019 0.437 . . . . 4.58 110.263 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.7 -12.53 78.1 Favored Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.655 -0.783 . . . . 1.5 111.43 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.415 ' C ' ' HD3' ' A' ' 7' ' ' PRO . 4.7 p -87.94 48.68 1.68 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 122.062 0.934 . . . . 1.68 110.084 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.499 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 20.7 mtm -139.23 55.24 7.07 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 114.488 -1.233 . . . . 2.28 108.155 173.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 6' ' ' MET . 68.1 Cg_exo -55.65 -47.25 26.41 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.529 2.152 . . . . 0.92 112.027 -170.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -80.88 13.27 2.74 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.567 -0.453 . . . . 1.2 111.564 -174.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 92.8 t -94.67 -27.95 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.25 -0.648 . . . . 0.61 109.25 169.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -103.27 -48.45 4.0 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 122.041 0.924 . . . . 2.74 108.684 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.648 ' HA ' HD22 ' A' ' 33' ' ' LEU . 2.8 m-85 -60.88 -51.42 69.37 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.196 -1.366 . . . . 0.56 110.182 -176.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 38.4 tt0 -58.24 -33.6 69.53 Favored 'General case' 0 C--O 1.222 -0.387 0 O-C-N 123.202 0.314 . . . . 1.26 111.552 -174.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -65.3 -49.5 69.28 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.475 0.655 . . . . 1.19 109.491 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.704 ' HB2' HD21 ' A' ' 33' ' ' LEU . 1.3 mp0 -66.97 -20.74 65.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.508 -0.769 . . . . 1.24 110.728 174.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' A' ' 29' ' ' ASN . 15.5 mt -78.18 -35.6 48.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.102 -0.499 . . . . 0.2 110.907 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.677 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.1 mt-10 -64.8 -34.29 78.01 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.78 0.8 . . . . 0.88 108.863 172.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.538 ' O ' ' HG2' ' A' ' 21' ' ' MET . 44.1 tt0 -63.92 -52.74 58.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.734 -1.121 . . . . 0.37 110.877 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.674 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 48.0 mt -64.67 -35.3 80.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.838 0.828 . . . . 0.17 109.128 177.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 7.6 t30 -53.95 -34.25 59.14 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.969 -1.469 . . . . 0.25 110.371 176.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 t -87.06 -14.75 40.6 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.159 -1.382 . . . . 0.66 110.012 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.674 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 26.0 mmm -82.21 -17.77 44.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.007 -0.997 . . . . 1.41 110.009 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.46 10.84 30.46 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.09 -0.959 . . . . 0.19 110.943 -172.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 50.3 m-85 -103.77 106.15 16.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.382 0.61 . . . . 0.37 110.414 178.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.07 15.87 3.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.701 -0.681 . . . . 0.23 111.469 -177.021 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 54.6 t30 -84.22 84.19 7.71 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.41 -1.7 . . . . 1.84 106.41 171.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.785 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mmp_? -45.85 -49.62 15.13 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 123.842 0.714 . . . . 1.63 111.762 -172.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -53.89 -51.23 64.35 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 123.953 0.783 . . . . 2.44 110.931 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.482 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -60.09 -52.66 64.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.689 0.281 . . . . 0.26 110.293 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.799 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.6 m-20 -48.0 -64.34 0.82 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.46 -0.791 . . . . 0.14 111.568 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.7 pp -73.93 -25.04 59.76 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 120.432 -0.507 . . . . 0.27 112.124 -172.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.481 ' N ' HD12 ' A' ' 30' ' ' LEU . 72.6 mt-30 -62.45 -35.64 79.94 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.865 0.841 . . . . 2.18 109.295 174.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.54 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -71.98 -33.08 67.85 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.471 -1.24 . . . . 0.12 108.49 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.704 HD21 ' HB2' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -78.01 -20.04 53.28 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.588 -1.187 . . . . 0.2 111.166 176.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.759 HG13 ' O ' ' A' ' 30' ' ' LEU . 34.6 mt -68.9 -49.08 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 109.053 -0.721 . . . . 0.34 109.053 174.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.03 -20.66 60.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.491 -0.777 . . . . 0.23 112.016 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.815 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 60.8 p -102.43 -18.72 15.24 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.585 -0.446 . . . . 0.17 111.874 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.74 26.13 74.76 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.315 -0.469 . . . . 0.29 113.533 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.99 20.98 8.01 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.398 -0.906 . . . . 0.37 111.729 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.815 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 63.0 t0 -103.9 87.17 2.73 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 106.735 -1.579 . . . . 0.64 106.735 176.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.675 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -65.85 -28.83 45.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-N 113.927 -1.488 . . . . 0.52 111.437 -167.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -61.43 -47.13 87.12 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.59 0.71 . . . . 1.29 109.251 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.662 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -75.25 -29.46 60.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.067 -0.97 . . . . 0.29 109.968 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.522 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -54.51 -45.07 73.22 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.24 110.294 171.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 40' ' ' ILE . 0.9 OUTLIER -68.34 -37.85 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 109.646 -0.501 . . . . 0.38 109.646 177.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -60.7 -20.09 60.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.892 -0.595 . . . . 2.35 110.688 174.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.662 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 64.1 mtp85 -87.6 -42.42 12.72 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.595 -0.442 . . . . 2.47 110.336 177.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.433 HD11 HD13 ' A' ' 18' ' ' LEU . 79.6 mt -62.72 -46.93 85.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.783 -0.644 . . . . 0.45 110.665 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 mt -75.75 -38.12 58.68 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.601 -0.727 . . . . 1.76 109.95 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.782 ' O ' ' HG3' ' A' ' 51' ' ' GLN . . . 87.55 93.24 0.97 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 109.357 -1.497 . . . . 1.28 109.357 -173.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m -28.89 101.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 O-C-N 125.141 1.142 . . . . 4.31 111.995 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.782 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 44.0 mt-30 -114.24 86.89 2.51 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.958 -1.019 . . . . 5.65 108.437 -178.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.415 HD12 ' N ' ' A' ' 52' ' ' LEU . 5.5 mp -110.76 77.11 1.02 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.668 -0.696 . . . . 9.0 109.746 -176.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.396 -0.82 . . . . 10.04 109.523 -179.082 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.578 0.704 . . . . 2.74 109.438 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.933 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.0 m-30 -62.06 -55.15 31.97 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 114.959 -1.019 . . . . 0.56 111.392 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.486 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 30.7 tt0 -62.5 -30.7 71.47 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.03 0.206 . . . . 1.26 111.195 -170.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.436 ' HA ' HE21 ' A' ' 13' ' ' GLN . 2.6 mm100 -73.19 -44.9 59.05 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.103 -0.702 . . . . 1.19 109.103 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.665 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.2 mp0 -62.49 -24.98 67.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.387 -0.824 . . . . 1.24 109.996 171.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 29' ' ' ASN . 12.2 mt -72.47 -35.23 68.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.227 -0.442 . . . . 0.2 110.077 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.591 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 27.1 mt-10 -67.07 -34.36 77.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.85 0.833 . . . . 0.88 109.639 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 20' ' ' SER . 9.2 tt0 -66.82 -46.8 74.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.497 178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 23' ' ' PHE . 52.4 mt -67.0 -32.5 73.78 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.918 0.866 . . . . 0.17 109.22 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.618 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.8 t30 -56.53 -28.21 59.47 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.976 -1.466 . . . . 0.25 110.524 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 17' ' ' GLN . 71.2 m -81.06 -19.56 43.49 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.92 -1.491 . . . . 0.66 110.112 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.5 mmm -98.75 3.79 47.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.18 -1.373 . . . . 1.41 110.55 -172.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.9 16.75 55.75 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.231 -0.895 . . . . 0.19 111.073 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 59.6 m-85 -108.01 104.28 13.69 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.362 0.601 . . . . 0.37 109.591 177.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.447 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -121.46 4.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.47 -0.786 . . . . 0.23 110.895 -175.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.474 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -78.47 81.8 4.78 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.59 -1.633 . . . . 1.84 106.59 171.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.764 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.0 mmp_? -43.01 -48.63 6.02 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.839 0.712 . . . . 1.63 110.926 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -45.73 -57.72 4.03 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.249 0.968 . . . . 2.44 111.161 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.474 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -63.73 -49.48 72.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.524 -0.307 . . . . 0.26 110.987 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.867 ' HB3' HD22 ' A' ' 15' ' ' LEU . 3.7 m-20 -48.28 -62.9 1.25 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 123.77 0.669 . . . . 0.14 111.551 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.4 pp -75.08 -24.48 58.16 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.173 -0.611 . . . . 0.27 112.294 -173.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.47 ' N ' HD12 ' A' ' 30' ' ' LEU . 10.1 mm100 -64.98 -32.64 74.47 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 122.057 0.932 . . . . 2.18 109.399 174.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.735 ' HA ' ' NH1' ' A' ' 46' ' ' ARG . . . -70.84 -38.19 73.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.314 -1.312 . . . . 0.12 107.835 177.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.0 OUTLIER -73.47 -21.8 60.33 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.719 -1.128 . . . . 0.2 111.596 176.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.698 HG13 ' O ' ' A' ' 30' ' ' LEU . 12.0 mt -68.29 -49.65 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 N-CA-C 109.801 -0.444 . . . . 0.34 109.801 176.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.558 ' HB3' ' NH1' ' A' ' 46' ' ' ARG . . . -76.66 -14.23 59.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.939 -0.573 . . . . 0.23 112.069 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.847 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 70.7 p -104.55 -18.25 14.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.757 -0.377 . . . . 0.17 111.694 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.16 35.04 87.95 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.51 -0.314 . . . . 0.29 113.372 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.1 10.47 36.67 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.325 -0.941 . . . . 0.37 111.364 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.847 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.2 t0 -94.09 87.14 5.2 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.241 -1.763 . . . . 0.64 106.241 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.761 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.74 -24.18 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 CA-C-N 114.644 -1.162 . . . . 0.52 111.058 -170.403 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -63.56 -52.2 62.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.716 -0.846 . . . . 1.29 108.716 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.72 -32.49 71.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.044 -0.98 . . . . 0.29 110.483 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -51.71 -51.71 53.93 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.573 0.225 . . . . 0.24 110.722 172.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.761 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.3 mt -61.32 -47.26 94.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 109.844 -0.428 . . . . 0.38 109.844 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.8 -20.67 65.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.414 . . . . 2.35 111.386 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.735 ' NH1' ' HA ' ' A' ' 32' ' ' ALA . 42.8 mtp180 -80.17 -34.67 37.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.883 0.373 . . . . 2.47 110.549 174.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.6 mt . . . . . 0 C--N 1.317 -0.829 0 CA-C-O 121.32 0.581 . . . . 0.45 110.416 177.613 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 . . . . . 0 C--O 1.234 0.255 0 CA-C-O 121.229 0.538 . . . . 2.74 110.069 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.789 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.8 m-85 -61.48 -54.79 38.66 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.744 -0.662 . . . . 0.56 111.845 -172.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 32.2 tt0 -59.72 -40.84 89.33 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.529 0.204 . . . . 1.26 111.197 -170.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -62.04 -48.0 82.21 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.499 0.666 . . . . 1.19 110.009 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.738 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.7 OUTLIER -66.45 -26.25 67.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.154 -0.93 . . . . 1.24 111.008 177.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.867 HD11 ' HB3' ' A' ' 30' ' ' LEU . 36.6 mt -73.35 -35.17 65.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.2 111.313 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 27.3 mt-10 -73.03 -27.15 61.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.558 0.694 . . . . 0.88 109.567 174.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.2 tt0 -65.09 -52.77 53.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.209 -0.905 . . . . 0.37 109.931 173.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.682 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 73.1 mt -62.49 -38.25 89.14 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.837 0.827 . . . . 0.17 108.982 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.3 t30 -49.87 -36.65 27.93 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.927 -1.488 . . . . 0.25 110.575 176.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 t -86.36 -19.3 29.97 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.949 -1.023 . . . . 0.66 110.227 -177.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.682 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 24.6 mmm -73.99 -19.97 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.122 -0.945 . . . . 1.41 110.016 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.24 15.63 15.44 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 110.57 -1.012 . . . . 0.19 110.57 -172.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 65.8 m-85 -113.65 107.2 15.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.075 0.464 . . . . 0.37 110.206 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.476 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -124.84 8.9 4.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.898 -0.592 . . . . 0.23 110.847 -174.821 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.59 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -76.12 79.68 2.94 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.242 -1.392 . . . . 1.84 107.242 172.143 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.73 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -46.73 -45.83 19.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 123.66 0.6 . . . . 1.63 111.193 -173.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 31' ' ' GLN . 2.3 mp0 -55.68 -46.98 77.48 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.858 0.724 . . . . 2.44 110.442 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.59 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -70.39 -44.32 68.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.338 -0.392 . . . . 0.26 110.269 -179.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.668 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.2 m-20 -54.0 -64.16 0.92 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.551 -0.75 . . . . 0.14 111.089 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.9 OUTLIER -73.56 -25.32 60.32 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.287 -0.565 . . . . 0.27 111.794 -172.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -66.76 -28.56 68.5 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 118.542 0.61 . . . . 2.18 110.109 175.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.84 -32.9 62.05 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.928 -1.138 . . . . 0.12 107.928 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 11' ' ' PHE . 2.1 mp -76.82 -20.52 56.26 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.82 -1.082 . . . . 0.2 111.286 174.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 30' ' ' LEU . 23.9 mt -73.89 -38.99 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.129 -0.693 . . . . 0.34 109.129 176.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.81 -21.34 47.88 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.26 -0.882 . . . . 0.23 111.471 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 43.6 p -103.78 -18.74 14.55 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.922 0.391 . . . . 0.17 111.808 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.18 29.96 68.01 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.29 113.67 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.74 20.84 10.26 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.085 -1.055 . . . . 0.37 111.969 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.516 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 10.7 t0 -104.1 89.63 3.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.837 -1.542 . . . . 0.64 106.837 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.23 -26.14 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 114.414 -1.267 . . . . 0.52 111.597 -168.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -50.02 71.49 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.668 -0.864 . . . . 1.29 108.668 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.09 -33.06 73.83 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.098 -0.956 . . . . 0.29 110.55 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.45 -49.27 67.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.676 -0.238 . . . . 0.24 111.017 172.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.809 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -65.01 -39.92 87.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 N-CA-C 109.919 -0.4 . . . . 0.38 109.919 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.0 -24.43 67.03 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.007 -0.542 . . . . 2.35 110.858 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 52.7 mtt180 -83.05 -33.37 26.46 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.862 -0.335 . . . . 2.47 110.855 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--N 1.321 -0.648 0 CA-C-O 120.916 0.389 . . . . 0.45 111.144 179.579 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 . . . . . 0 C--O 1.24 0.581 0 CA-C-O 121.763 0.792 . . . . 2.74 109.13 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.661 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.5 m-30 -61.97 -55.47 29.04 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 114.81 -1.086 . . . . 0.56 111.462 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.547 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.5 tt0 -59.8 -33.28 71.52 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.836 -0.346 . . . . 1.26 111.642 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -62.83 -48.87 77.19 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.702 0.763 . . . . 1.19 109.403 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.508 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -68.89 -21.09 64.26 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.091 -0.959 . . . . 1.24 111.022 174.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.859 HD22 ' HB3' ' A' ' 29' ' ' ASN . 13.6 mt -74.37 -30.78 62.12 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 110.161 -0.311 . . . . 0.2 110.161 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.639 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 31.3 mt-10 -72.31 -30.0 64.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.886 0.85 . . . . 0.88 109.324 172.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 21' ' ' MET . 9.5 tt0 -66.44 -48.56 69.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.272 -0.876 . . . . 0.37 110.198 174.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.879 ' HG ' HD11 ' A' ' 40' ' ' ILE . 71.8 mt -68.73 -31.49 70.59 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.941 -0.763 . . . . 0.17 108.941 177.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.639 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 8.6 t30 -50.22 -37.21 34.35 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.202 -1.363 . . . . 0.25 109.817 173.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -86.68 -4.52 59.19 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.31 -1.314 . . . . 0.66 110.67 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.747 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 30.6 mtt -96.12 -9.2 31.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.542 0.687 . . . . 1.41 109.223 178.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.2 15.99 36.65 Favored Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.008 -0.996 . . . . 0.19 111.369 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.477 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 34.6 m-85 -108.84 110.64 22.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.411 0.624 . . . . 0.37 110.032 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.57 1.83 4.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 115.291 -0.868 . . . . 0.23 111.285 -174.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.477 ' ND2' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -72.05 78.05 0.93 Allowed 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.368 -1.345 . . . . 1.84 107.368 165.124 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 15.9 mmt85 -47.45 -35.3 8.36 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.964 -1.017 . . . . 1.63 109.95 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 35.9 mt-10 -53.31 -61.99 1.94 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.033 -0.985 . . . . 2.44 111.71 173.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.477 ' HB3' ' ND2' ' A' ' 25' ' ' ASN . . . -70.82 -37.0 73.19 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.064 -0.254 . . . . 0.26 110.598 -174.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.859 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.3 m-20 -49.67 -64.3 0.85 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.036 -0.529 . . . . 0.14 110.639 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.8 pp -74.74 -24.81 58.77 Favored 'General case' 0 C--O 1.212 -0.918 0 C-N-CA 119.852 -0.739 . . . . 0.27 112.323 -173.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.542 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.1 mm100 -61.25 -34.78 75.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.683 0.754 . . . . 2.18 109.406 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.71 -33.5 64.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.503 -1.226 . . . . 0.12 108.784 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.764 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -76.56 -20.76 56.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.326 -0.852 . . . . 0.2 110.975 175.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.755 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.4 mt -70.12 -41.25 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 109.118 -0.697 . . . . 0.34 109.118 174.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.93 -33.48 70.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.386 -0.825 . . . . 0.23 111.267 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.747 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 80.7 p -96.12 -18.81 19.86 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.956 0.354 . . . . 0.17 111.956 -177.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.68 33.02 56.59 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.29 112.717 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.764 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.45 10.8 56.59 Favored Glycine 0 CA--C 1.499 -0.951 0 C-N-CA 120.476 -0.869 . . . . 0.37 111.229 176.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.747 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.8 t70 -87.66 88.66 7.73 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 106.43 -1.693 . . . . 0.64 106.43 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.879 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -70.86 -22.4 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.025 -0.989 . . . . 0.52 111.738 -166.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.99 -51.41 66.94 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.611 -0.885 . . . . 1.29 108.611 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -65.8 -34.1 77.38 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.725 -1.125 . . . . 0.29 109.95 177.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 40' ' ' ILE . . . -58.75 -48.86 79.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.266 -0.424 . . . . 0.24 111.496 176.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.828 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.0 mt -62.9 -45.77 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 N-CA-C 109.96 -0.385 . . . . 0.38 109.96 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HG2' ' HA ' ' A' ' 42' ' ' ALA . 9.3 pt-20 -69.26 -19.41 63.92 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.495 -0.482 . . . . 2.35 110.593 -177.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 48.0 mtt180 -78.17 -35.8 48.31 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 120.58 -0.448 . . . . 2.47 109.981 173.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.45 110.71 178.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 . . . . . 0 C--O 1.238 0.451 0 N-CA-C 108.723 -0.843 . . . . 2.74 108.723 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.698 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.7 m-30 -61.2 -50.74 71.88 Favored 'General case' 0 C--O 1.214 -0.801 0 CA-C-N 114.515 -1.22 . . . . 0.56 109.92 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.0 tt0 -56.01 -39.46 71.95 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 123.207 0.317 . . . . 1.26 111.389 -177.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -63.37 -44.86 93.58 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.671 0.748 . . . . 1.19 109.502 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.672 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.0 OUTLIER -73.66 -19.28 60.88 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.189 -0.914 . . . . 1.24 111.216 175.166 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.9 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.6 mt -77.88 -36.24 49.94 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 110.04 -0.355 . . . . 0.2 110.04 -178.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 29.0 mt-10 -70.79 -29.02 65.1 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.77 0.669 . . . . 0.88 109.64 172.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -66.28 -51.7 54.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.37 110.045 174.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.872 ' HG ' HD11 ' A' ' 40' ' ' ILE . 79.5 mt -63.61 -34.74 78.5 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.938 0.875 . . . . 0.17 108.885 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.625 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.2 t30 -53.19 -34.87 58.81 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.902 -1.499 . . . . 0.25 110.266 175.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.4 t -86.8 -12.01 49.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.625 -1.17 . . . . 0.66 110.01 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.9 mmm -90.86 -5.55 55.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.266 -0.879 . . . . 1.41 109.892 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.17 15.99 39.61 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.323 -0.853 . . . . 0.19 111.195 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.503 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.4 m-85 -111.42 107.41 16.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.135 0.493 . . . . 0.37 109.771 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.485 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -127.29 8.44 3.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.802 -0.635 . . . . 0.23 111.322 -173.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.425 HD22 ' HB2' ' A' ' 27' ' ' GLU . 1.1 t30 -82.96 85.7 7.1 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 106.423 -1.695 . . . . 1.84 106.423 170.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.836 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.2 mmp_? -42.81 -47.52 5.53 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.069 0.856 . . . . 1.63 110.555 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.425 ' HB2' HD22 ' A' ' 25' ' ' ASN . 35.6 mt-10 -44.39 -57.1 3.73 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.587 1.18 . . . . 2.44 111.275 175.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.09 64.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.888 0.375 . . . . 0.26 110.347 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.804 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.7 -65.03 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.162 -0.926 . . . . 0.14 111.556 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.9 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.7 pp -73.15 -28.11 62.05 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 119.126 -0.464 . . . . 0.27 111.969 -172.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.56 ' N ' HD12 ' A' ' 30' ' ' LEU . 18.5 mt-30 -60.09 -37.02 78.71 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.731 0.776 . . . . 2.18 109.678 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -72.17 -31.67 66.14 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.363 -1.29 . . . . 0.12 108.814 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.768 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -79.33 -19.59 49.98 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.218 -0.901 . . . . 0.2 111.17 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.1 mt -71.09 -44.18 75.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.777 -0.823 . . . . 0.34 108.777 173.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.97 -27.21 66.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.202 -0.908 . . . . 0.23 111.287 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.832 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 54.7 p -101.73 -19.38 15.4 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.53 0.567 . . . . 0.17 112.53 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.52 26.12 72.53 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.06 -0.59 . . . . 0.29 112.201 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.768 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 98.44 18.76 25.07 Favored Glycine 0 CA--C 1.5 -0.855 0 C-N-CA 120.66 -0.781 . . . . 0.37 111.472 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.832 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 18.4 t70 -94.04 87.87 5.48 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.395 -1.705 . . . . 0.64 106.395 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.872 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -68.94 -23.92 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 114.849 -1.068 . . . . 0.52 110.923 -166.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 60.3 m-20 -52.51 -57.39 10.07 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.25 0.548 . . . . 1.29 109.717 173.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' A' ' 45' ' ' GLU . . . -72.55 -22.32 61.03 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.319 -0.855 . . . . 0.29 111.09 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.445 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -58.23 -48.63 79.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 121.162 -0.215 . . . . 0.24 110.585 168.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.449 HD13 ' CE ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -70.74 -32.98 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 120.544 -0.462 . . . . 0.38 110.753 177.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 6.9 mm-40 -61.61 -22.72 65.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.087 0.47 . . . . 2.35 110.098 174.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -88.76 -44.59 10.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.954 -0.566 . . . . 2.47 111.195 175.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-O 120.855 0.359 . . . . 0.45 111.678 -179.473 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 . . . . . 0 C--O 1.242 0.66 0 N-CA-C 108.76 -0.83 . . . . 2.74 108.76 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.786 ' HA ' HD22 ' A' ' 33' ' ' LEU . 17.7 m-30 -62.55 -55.28 28.78 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 114.937 -1.029 . . . . 0.56 111.968 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.484 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 50.8 tt0 -56.97 -42.43 80.16 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.778 0.288 . . . . 1.26 111.778 -172.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 13' ' ' GLN . 20.0 mm-40 -60.17 -45.75 92.01 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.649 0.737 . . . . 1.19 110.181 178.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.724 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -72.77 -21.0 61.07 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.892 -1.049 . . . . 1.24 111.444 176.348 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.854 HD22 ' HB3' ' A' ' 29' ' ' ASN . 11.8 mt -73.73 -37.6 65.06 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.267 -0.271 . . . . 0.2 110.267 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 29.8 mt-10 -69.68 -28.7 66.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.721 0.772 . . . . 0.88 109.376 174.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 21' ' ' MET . 9.1 tt0 -67.51 -46.33 73.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.407 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.541 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 42.6 mt -67.56 -31.9 72.29 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.082 0.944 . . . . 0.17 108.914 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.558 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.3 t30 -57.07 -30.5 64.34 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 113.633 -1.621 . . . . 0.25 109.966 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -83.11 -19.8 36.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.478 -1.237 . . . . 0.66 109.9 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 13.3 mmt -80.18 -17.55 52.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.135 -0.939 . . . . 1.41 109.889 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.25 13.45 28.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.391 -1.083 . . . . 0.19 110.391 -171.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.6 m-85 -105.14 108.89 20.65 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.298 0.57 . . . . 0.37 110.856 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -125.33 13.02 4.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.627 -0.715 . . . . 0.23 111.367 -174.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 3.2 t30 -84.99 80.25 9.36 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 106.736 -1.579 . . . . 1.84 106.736 173.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.771 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.1 mmp_? -43.18 -49.23 6.53 Favored 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.934 0.771 . . . . 1.63 111.322 -174.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -47.73 -55.93 8.46 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 124.602 1.189 . . . . 2.44 110.537 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.542 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -66.75 -46.91 73.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.144 -0.48 . . . . 0.26 110.744 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.854 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.05 -64.23 0.85 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.641 -0.709 . . . . 0.14 111.31 177.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.6 pp -71.84 -27.31 62.81 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 120.376 -0.53 . . . . 0.27 111.976 -174.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.504 ' N ' HD12 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.03 -30.85 71.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.348 0.594 . . . . 2.18 109.93 176.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.88 -32.89 61.98 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.574 -0.899 . . . . 0.12 108.574 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.9 mp -73.95 -23.7 59.54 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.21 -0.905 . . . . 0.2 111.334 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.4 mt -72.18 -37.55 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.278 -0.638 . . . . 0.34 109.278 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.8 -27.5 60.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.723 -0.671 . . . . 0.23 111.305 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.672 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 66.0 p -99.95 -17.96 17.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.298 -0.41 . . . . 0.17 111.696 -177.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.99 29.77 70.5 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.29 113.056 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.03 22.0 10.44 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 119.979 -1.105 . . . . 0.37 111.48 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.672 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t0 -104.51 89.09 3.11 Favored 'General case' 0 CA--C 1.499 -1.011 0 N-CA-C 106.597 -1.631 . . . . 0.64 106.597 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.711 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -66.95 -25.14 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 CA-C-N 114.374 -1.285 . . . . 0.52 111.599 -168.316 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.18 -49.34 74.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.579 -0.897 . . . . 1.29 108.579 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.624 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -67.95 -33.43 74.64 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.851 -1.068 . . . . 0.29 110.077 177.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.49 67.65 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 111.376 0.139 . . . . 0.24 111.376 173.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -40.14 87.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 CA-C-O 120.744 0.306 . . . . 0.38 110.226 178.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -67.9 -19.62 65.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.233 -0.44 . . . . 2.35 110.585 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 57.3 mtp85 -77.79 -47.73 18.24 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.158 -0.617 . . . . 2.47 109.597 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.462 HD11 HD13 ' A' ' 18' ' ' LEU . 24.3 mt . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.272 -0.876 . . . . 0.45 111.485 -177.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 . . . . . 0 C--O 1.242 0.659 0 CA-C-O 121.663 0.744 . . . . 2.74 110.001 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.665 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 12.5 m-30 -62.39 -54.91 33.43 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 115.005 -0.998 . . . . 0.56 112.204 -174.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 8.8 tt0 -58.84 -36.87 75.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.197 -0.201 . . . . 1.26 111.049 -173.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -64.18 -41.46 97.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.813 0.816 . . . . 1.19 109.937 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.79 ' HB3' HG13 ' A' ' 40' ' ' ILE . 33.4 mt-30 -74.98 -21.12 59.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.118 -0.946 . . . . 1.24 110.931 175.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 30' ' ' LEU . 20.1 mt -75.46 -36.67 60.65 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.591 -0.277 . . . . 0.2 110.317 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.6 mt-10 -73.43 -26.02 60.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.499 0.666 . . . . 0.88 109.975 174.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.97 -50.87 60.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.267 -0.878 . . . . 0.37 109.723 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.852 ' HG ' HD11 ' A' ' 40' ' ' ILE . 33.0 mt -63.37 -34.71 78.31 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.9 0.857 . . . . 0.17 109.135 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 5.4 t30 -53.92 -34.93 60.99 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.031 -1.441 . . . . 0.25 110.275 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 t -87.23 -6.2 58.66 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.558 -1.201 . . . . 0.66 109.822 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.564 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 7.2 mmm -98.33 -4.72 34.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.966 -1.016 . . . . 1.41 109.864 -178.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.69 18.23 33.24 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.3 -0.864 . . . . 0.19 111.295 -177.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.513 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 60.8 m-85 -113.4 109.32 18.5 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.116 0.484 . . . . 0.37 109.764 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.529 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -126.98 0.88 3.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.054 -0.521 . . . . 0.23 111.596 -172.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.69 82.31 3.32 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.117 -1.438 . . . . 1.84 107.117 171.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.5 mmp_? -41.64 -49.0 4.19 Favored 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 124.011 0.819 . . . . 1.63 110.933 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 2.4 mm-40 -43.59 -58.57 2.58 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.729 1.268 . . . . 2.44 110.588 176.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.83 -49.23 63.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.26 110.723 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.797 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.1 m-20 -45.55 -64.25 0.77 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.745 0.653 . . . . 0.14 111.385 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.1 pp -72.99 -27.01 61.55 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-O 119.006 -0.521 . . . . 0.27 112.189 -173.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.509 ' N ' HD12 ' A' ' 30' ' ' LEU . 23.6 mm-40 -60.78 -35.33 76.16 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.711 0.767 . . . . 2.18 109.389 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.469 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -73.12 -33.16 65.38 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.563 -1.199 . . . . 0.12 108.718 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.62 HD21 ' CB ' ' A' ' 14' ' ' GLN . 2.3 mp -75.84 -25.61 56.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.164 -0.926 . . . . 0.2 111.387 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 30' ' ' LEU . 5.3 mt -73.99 -32.71 34.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.394 0.616 . . . . 0.34 109.391 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.624 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -79.55 -23.54 42.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.455 -0.793 . . . . 0.23 111.139 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 45.7 p -104.79 -17.98 14.41 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.214 0.45 . . . . 0.17 112.214 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.72 32.21 70.61 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 121.408 -0.425 . . . . 0.29 113.051 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.93 37.88 5.06 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 119.884 -1.15 . . . . 0.37 111.43 176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.458 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t70 -119.38 87.11 2.68 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 106.119 -1.808 . . . . 0.64 106.119 172.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.868 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -65.55 -24.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.557 0 CA-C-N 113.836 -1.529 . . . . 0.52 111.644 -166.597 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -62.03 -50.44 72.01 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.938 -0.764 . . . . 1.29 108.938 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.584 ' O ' ' HG3' ' A' ' 45' ' ' GLU . . . -68.88 -32.13 71.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.876 -1.056 . . . . 0.29 110.367 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.523 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -56.14 -49.85 72.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 121.26 -0.176 . . . . 0.24 110.882 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.868 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.6 mt -63.29 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.699 0.285 . . . . 0.38 110.812 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.584 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -72.99 -19.6 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.745 -0.382 . . . . 2.35 110.585 -176.3 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.624 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 75.3 mtt180 -84.85 -27.11 26.95 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.974 0.416 . . . . 2.47 110.409 173.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 96.2 mt . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 0.45 110.071 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? . . . . . 0 C--O 1.238 0.45 0 CA-C-O 121.581 0.705 . . . . 2.74 109.156 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.806 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.2 m-30 -61.54 -54.6 40.93 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.849 -1.069 . . . . 0.56 111.375 -172.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.616 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.9 tt0 -59.54 -34.34 72.52 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 121.235 -0.186 . . . . 1.26 111.492 -172.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.02 -47.42 77.5 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.578 0.704 . . . . 1.19 109.427 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.752 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.1 mp0 -69.6 -19.28 63.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.282 -0.872 . . . . 1.24 111.203 174.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.641 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.5 mt -73.75 -40.2 63.67 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.621 -0.511 . . . . 0.2 109.621 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 33.3 mt-10 -64.54 -31.35 72.53 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.827 0.822 . . . . 0.88 109.59 173.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.51 ' NE2' HG21 ' A' ' 40' ' ' ILE . 8.1 tt0 -66.83 -50.63 61.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.096 -0.956 . . . . 0.37 111.056 175.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.681 ' HG ' HD11 ' A' ' 40' ' ' ILE . 62.0 mt -66.37 -30.15 70.47 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.854 0.835 . . . . 0.17 108.871 177.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.9 t30 -54.23 -35.29 62.3 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.051 -1.431 . . . . 0.25 110.3 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 t -87.1 -3.74 59.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.727 -1.124 . . . . 0.66 110.027 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.619 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 31.6 mmm -97.48 -8.38 29.38 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.306 -0.861 . . . . 1.41 109.718 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.28 16.89 33.39 Favored Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.27 -0.877 . . . . 0.19 111.153 -176.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.52 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.3 m-85 -110.63 109.52 19.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.37 109.879 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.76 -8.06 10.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.764 -0.653 . . . . 0.23 111.43 -172.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -73.13 83.14 1.3 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.94 -1.504 . . . . 1.84 106.94 169.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.89 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 57.2 mtt85 -60.98 -26.01 67.26 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.218 -0.446 . . . . 1.63 110.717 -175.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -52.76 -50.5 63.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.433 -0.58 . . . . 2.44 109.433 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.52 -46.26 60.14 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.987 -0.551 . . . . 0.26 110.421 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' CB ' HD22 ' A' ' 15' ' ' LEU . 6.6 m-20 -50.82 -60.41 3.09 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.659 -0.701 . . . . 0.14 111.268 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.89 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 2.0 pp -73.87 -24.22 59.71 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 120.294 -0.563 . . . . 0.27 112.343 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.546 ' N ' HD12 ' A' ' 30' ' ' LEU . 17.4 mm-40 -60.85 -34.66 74.93 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.88 0.848 . . . . 2.18 109.328 172.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -31.17 61.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.285 -1.325 . . . . 0.12 108.176 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.806 HD22 ' HA ' ' A' ' 11' ' ' PHE . 0.9 OUTLIER -79.68 -22.06 43.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.166 -0.925 . . . . 0.2 111.233 177.289 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.752 HG13 ' O ' ' A' ' 30' ' ' LEU . 6.0 mt -73.33 -38.5 53.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.641 -0.503 . . . . 0.34 109.641 175.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.6 -22.16 54.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.852 -0.613 . . . . 0.23 111.152 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.476 ' OG1' ' HA ' ' A' ' 33' ' ' LEU . 46.4 p -102.86 -18.78 14.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.338 0.496 . . . . 0.17 112.338 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.93 28.86 59.94 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 121.343 -0.456 . . . . 0.29 113.241 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.748 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 103.07 10.17 37.54 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.103 -1.046 . . . . 0.37 111.487 176.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.474 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.3 t70 -96.52 87.88 4.53 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 107.117 -1.438 . . . . 0.64 107.117 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.8 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -64.59 -25.72 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-N 114.11 -1.404 . . . . 0.52 111.536 -169.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 5.5 m-80 -60.51 -53.91 51.8 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.829 -0.804 . . . . 1.29 108.829 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.26 -30.9 70.04 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.437 -0.801 . . . . 0.29 110.559 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -46.32 74.0 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.395 -0.366 . . . . 0.24 110.543 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.8 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -68.13 -37.53 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.892 -0.41 . . . . 0.38 109.892 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 41' ' ' ASN . 51.0 mt-10 -65.7 -21.12 66.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.93 -0.577 . . . . 2.35 110.935 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 54.1 mtt180 -87.33 -40.95 14.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.312 -0.404 . . . . 2.47 110.845 176.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.995 0.426 . . . . 0.45 110.685 177.472 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 . . . . . 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 2.74 110.151 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.651 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 17.2 m-30 -61.44 -54.55 42.02 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 115.238 -0.892 . . . . 0.56 110.318 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 8.6 tt0 -55.78 -35.56 66.39 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 123.368 0.417 . . . . 1.26 111.51 -175.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -64.56 -49.65 70.38 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.566 0.698 . . . . 1.19 109.267 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.506 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -68.75 -19.04 64.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.147 -0.933 . . . . 1.24 111.038 174.378 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.3 mt -75.97 -35.85 59.49 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 122.027 -0.42 . . . . 0.2 110.083 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 30.7 mt-10 -71.93 -25.6 61.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.538 0.685 . . . . 0.88 109.362 173.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.408 HE21 HD12 ' A' ' 40' ' ' ILE . 9.7 tt0 -70.01 -46.28 65.44 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.444 -0.798 . . . . 0.37 110.569 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.886 ' HG ' HD11 ' A' ' 40' ' ' ILE . 63.7 mt -69.47 -33.56 73.08 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.281 -1.007 . . . . 0.17 108.281 177.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 6.1 t30 -51.8 -35.01 42.58 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.482 -1.69 . . . . 0.25 110.146 173.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.6 t -86.57 -11.1 52.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.592 -1.186 . . . . 0.66 110.378 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.651 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.2 mmm -90.45 -13.26 35.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.716 -0.675 . . . . 1.41 110.204 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.02 13.32 27.49 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-N 115.386 -0.825 . . . . 0.19 111.349 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.423 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m-85 -111.12 107.96 17.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.244 0.545 . . . . 0.37 110.392 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.49 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -123.79 6.22 5.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.94 -0.573 . . . . 0.23 111.37 -174.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.484 ' ND2' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -75.9 79.16 2.8 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.383 -1.339 . . . . 1.84 107.383 167.437 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.795 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 9.0 mmt85 -46.36 -39.48 10.4 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.574 -0.739 . . . . 1.63 109.926 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -46.94 -62.19 1.52 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.649 -1.16 . . . . 2.44 111.429 172.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.484 ' HB3' ' ND2' ' A' ' 25' ' ' ASN . . . -72.77 -39.69 66.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.802 -0.359 . . . . 0.26 110.76 -175.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.786 ' HB3' HD22 ' A' ' 15' ' ' LEU . 7.3 m-20 -49.34 -64.95 0.66 Allowed 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 123.284 0.365 . . . . 0.14 111.082 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.895 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.3 pp -74.98 -26.53 59.64 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 119.835 -0.746 . . . . 0.27 112.364 -171.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.595 ' N ' HD12 ' A' ' 30' ' ' LEU . 23.4 mt-30 -63.65 -33.3 75.32 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.763 0.792 . . . . 2.18 109.661 176.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.45 67.23 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.499 -1.228 . . . . 0.12 108.541 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.745 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -74.78 -23.24 58.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.316 -0.857 . . . . 0.2 110.935 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.773 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.6 mt -70.72 -36.85 66.75 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.649 0.738 . . . . 0.34 109.246 175.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.593 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -78.65 -20.52 50.08 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.055 -0.975 . . . . 0.23 111.501 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 63.3 p -108.36 -19.1 13.58 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.852 -0.339 . . . . 0.17 111.817 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.8 26.46 58.54 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 121.473 -0.394 . . . . 0.29 112.908 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.745 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 97.69 16.87 32.47 Favored Glycine 0 CA--C 1.497 -1.059 0 C-N-CA 120.2 -1.0 . . . . 0.37 111.311 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.621 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.0 t70 -93.13 93.06 8.08 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 105.405 -2.072 . . . . 0.64 105.405 170.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.886 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.77 -25.05 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-N 114.862 -1.063 . . . . 0.52 111.355 -166.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -59.52 -52.03 67.29 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.295 -0.631 . . . . 1.29 109.295 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' GLU . . . -69.8 -27.18 64.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.318 -0.855 . . . . 0.29 110.288 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.497 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -61.65 -49.2 77.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.24 110.859 173.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.83 HG13 ' O ' ' A' ' 40' ' ' ILE . 2.6 mt -65.88 -38.63 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 120.685 0.278 . . . . 0.38 110.264 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 42' ' ' ALA . 6.4 pt-20 -66.71 -24.24 66.22 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.905 -0.318 . . . . 2.35 110.487 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.593 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 61.0 mtt180 -82.17 -29.67 31.41 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.626 -0.43 . . . . 2.47 110.091 175.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 44' ' ' ILE . 91.4 mt . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 116.263 -0.426 . . . . 0.45 110.808 177.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 . . . . . 0 C--O 1.238 0.453 0 CA-C-O 121.32 0.581 . . . . 2.74 109.793 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.731 ' HA ' HD22 ' A' ' 33' ' ' LEU . 18.3 m-30 -62.36 -55.21 30.23 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.308 -0.86 . . . . 0.56 111.679 -171.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.584 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 29.4 tt0 -58.68 -37.49 76.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 117.931 0.332 . . . . 1.26 110.979 -171.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -59.8 -52.07 67.04 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 122.212 1.006 . . . . 1.19 109.395 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.687 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -70.24 -20.04 63.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.182 -1.372 . . . . 1.24 111.365 178.289 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.0 mt -74.92 -35.09 62.2 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 122.348 -0.22 . . . . 0.2 110.652 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 34.3 mt-10 -70.68 -29.84 66.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.786 0.803 . . . . 0.88 109.18 173.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.402 ' HB3' ' O ' ' A' ' 14' ' ' GLN . 9.3 tt0 -66.28 -48.14 71.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.976 -1.011 . . . . 0.37 110.489 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.873 ' HG ' HD11 ' A' ' 40' ' ' ILE . 67.1 mt -69.59 -31.86 70.26 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.849 -0.797 . . . . 0.17 108.849 177.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.64 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.7 t30 -50.92 -34.35 28.12 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.181 -1.372 . . . . 0.25 110.062 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -86.71 -14.96 40.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.415 -1.266 . . . . 0.66 110.61 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 23.5 mtt -85.41 -10.76 55.78 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.488 0.661 . . . . 1.41 109.961 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.34 10.91 43.5 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 110.808 -0.917 . . . . 0.19 110.808 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.0 m-85 -107.73 109.32 20.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.582 0.706 . . . . 0.37 110.625 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.53 9.8 3.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 115.554 -0.748 . . . . 0.23 111.063 -174.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.585 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 2.3 t30 -79.34 79.8 5.76 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 106.882 -1.525 . . . . 1.84 106.882 172.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.769 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 58.7 mmt-85 -46.04 -44.46 15.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.891 0.745 . . . . 1.63 111.948 -171.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.6 -49.98 75.67 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.514 0.508 . . . . 2.44 110.304 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -64.06 -47.77 78.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.18 -0.304 . . . . 0.26 110.18 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.773 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.5 m-20 -48.48 -63.46 1.08 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.656 -0.702 . . . . 0.14 111.036 176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.808 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.2 pp -73.8 -25.46 60.13 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 120.307 -0.557 . . . . 0.27 112.395 -172.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.6 mt-30 -64.32 -32.48 74.1 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.753 0.787 . . . . 2.18 109.848 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -73.4 -33.46 64.99 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.861 -1.063 . . . . 0.12 108.591 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.8 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -75.19 -24.61 57.85 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.09 -0.959 . . . . 0.2 110.991 175.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.779 HG13 ' O ' ' A' ' 30' ' ' LEU . 26.4 mt -67.75 -48.29 76.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.363 -0.606 . . . . 0.34 109.363 175.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.4 -28.0 68.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.432 -0.804 . . . . 0.23 111.681 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.699 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 40.2 p -98.49 -18.76 18.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.865 0.364 . . . . 0.17 111.921 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.53 21.32 60.32 Favored Glycine 0 C--N 1.322 -0.23 0 C-N-CA 121.202 -0.523 . . . . 0.29 112.346 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.8 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.77 16.5 38.94 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 111.047 -0.821 . . . . 0.37 111.047 -178.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 19.7 t70 -90.89 87.73 6.75 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 106.041 -1.837 . . . . 0.64 106.041 175.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.873 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -73.54 -27.11 22.83 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.955 -1.02 . . . . 0.52 113.02 -158.495 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 8.8 p30 -60.97 -43.25 99.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.91 -0.774 . . . . 1.29 108.91 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -72.69 -30.6 64.36 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.022 -0.99 . . . . 0.29 110.639 176.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.52 91.53 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.468 -0.333 . . . . 0.24 110.83 172.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.1 mt -65.98 -38.71 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 N-CA-C 109.356 -0.609 . . . . 0.38 109.356 176.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 21.5 mm-40 -58.19 -30.39 66.39 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.505 -0.77 . . . . 2.35 110.41 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.3 mtp85 -77.96 -43.73 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.687 0.28 . . . . 2.47 110.742 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.6 mt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 0.45 111.493 -177.684 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 . . . . . 0 C--O 1.242 0.658 0 CA-C-O 122.041 0.924 . . . . 2.74 108.684 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.648 ' HA ' HD22 ' A' ' 33' ' ' LEU . 2.8 m-85 -60.88 -51.42 69.37 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.196 -1.366 . . . . 0.56 110.182 -176.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 7.0 tt0 -58.24 -33.6 69.53 Favored 'General case' 0 C--O 1.222 -0.387 0 O-C-N 123.202 0.314 . . . . 1.26 111.552 -174.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -65.3 -49.5 69.28 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.475 0.655 . . . . 1.19 109.491 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.704 ' HB2' HD21 ' A' ' 33' ' ' LEU . 1.3 mp0 -66.97 -20.74 65.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.508 -0.769 . . . . 1.24 110.728 174.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' A' ' 29' ' ' ASN . 15.5 mt -78.18 -35.6 48.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.102 -0.499 . . . . 0.2 110.907 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.677 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.1 mt-10 -64.8 -34.29 78.01 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.78 0.8 . . . . 0.88 108.863 172.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.538 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.4 tt0 -63.92 -52.74 58.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.734 -1.121 . . . . 0.37 110.877 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.674 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 48.0 mt -64.67 -35.3 80.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.838 0.828 . . . . 0.17 109.128 177.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 7.6 t30 -53.95 -34.25 59.14 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.969 -1.469 . . . . 0.25 110.371 176.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 t -87.06 -14.75 40.6 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.159 -1.382 . . . . 0.66 110.012 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.674 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 26.0 mmm -82.21 -17.77 44.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.007 -0.997 . . . . 1.41 110.009 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.46 10.84 30.46 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.09 -0.959 . . . . 0.19 110.943 -172.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 50.3 m-85 -103.77 106.15 16.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.382 0.61 . . . . 0.37 110.414 178.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.07 15.87 3.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.701 -0.681 . . . . 0.23 111.469 -177.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 54.6 t30 -84.22 84.19 7.71 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.41 -1.7 . . . . 1.84 106.41 171.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.785 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mmp_? -45.85 -49.62 15.13 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 123.842 0.714 . . . . 1.63 111.762 -172.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -53.89 -51.23 64.35 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 123.953 0.783 . . . . 2.44 110.931 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.482 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -60.09 -52.66 64.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.689 0.281 . . . . 0.26 110.293 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.799 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.6 m-20 -48.0 -64.34 0.82 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.46 -0.791 . . . . 0.14 111.568 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.7 pp -73.93 -25.04 59.76 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 120.432 -0.507 . . . . 0.27 112.124 -172.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.481 ' N ' HD12 ' A' ' 30' ' ' LEU . 16.5 mt-30 -62.45 -35.64 79.94 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.865 0.841 . . . . 2.18 109.295 174.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.54 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -71.98 -33.08 67.85 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.471 -1.24 . . . . 0.12 108.49 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.704 HD21 ' HB2' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -78.01 -20.04 53.28 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.588 -1.187 . . . . 0.2 111.166 176.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.759 HG13 ' O ' ' A' ' 30' ' ' LEU . 34.6 mt -68.9 -49.08 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 109.053 -0.721 . . . . 0.34 109.053 174.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.03 -20.66 60.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.491 -0.777 . . . . 0.23 112.016 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.815 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 60.8 p -102.43 -18.72 15.24 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.585 -0.446 . . . . 0.17 111.874 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.74 26.13 74.76 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.315 -0.469 . . . . 0.29 113.533 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.99 20.98 8.01 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.398 -0.906 . . . . 0.37 111.729 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.815 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 63.0 t0 -103.9 87.17 2.73 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 106.735 -1.579 . . . . 0.64 106.735 176.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.675 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -65.85 -28.83 45.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-N 113.927 -1.488 . . . . 0.52 111.437 -167.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -61.43 -47.13 87.12 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.59 0.71 . . . . 1.29 109.251 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.662 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -75.25 -29.46 60.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.067 -0.97 . . . . 0.29 109.968 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.522 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -54.51 -45.07 73.22 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.24 110.294 171.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 40' ' ' ILE . 0.9 OUTLIER -68.34 -37.85 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 109.646 -0.501 . . . . 0.38 109.646 177.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -60.7 -20.09 60.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.892 -0.595 . . . . 2.35 110.688 174.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.662 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 64.1 mtp85 -87.6 -42.42 12.72 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.595 -0.442 . . . . 2.47 110.336 177.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.433 HD11 HD13 ' A' ' 18' ' ' LEU . 79.6 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.783 -0.644 . . . . 0.45 110.665 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 112.093 -0.403 . . . . 6.75 112.093 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.73 123.46 13.34 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.849 2.366 . . . . 6.37 111.294 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 92.7 mt -84.74 110.62 18.92 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.931 -0.577 . . . . 4.58 111.788 -173.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.01 -6.01 88.88 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.233 -0.747 . . . . 1.5 111.233 171.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.0 m -87.0 47.68 1.54 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.942 0.877 . . . . 1.68 109.007 174.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.475 ' HB2' ' HE2' ' A' ' 6' ' ' MET . 44.3 mtm -145.23 65.81 12.03 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.55 -1.648 . . . . 2.28 106.55 174.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -52.31 -34.64 61.0 Favored 'Trans proline' 0 CA--C 1.522 -0.124 0 C-N-CA 123.519 2.813 . . . . 0.92 114.685 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.65 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 26.0 mt-10 -68.56 -16.89 64.02 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 120.482 -0.487 . . . . 1.2 111.926 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.0 t -65.59 -24.26 34.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.435 0.636 . . . . 0.61 109.701 175.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -102.13 -48.15 4.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.578 0.704 . . . . 2.74 109.438 171.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.933 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.0 m-30 -62.06 -55.15 31.97 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 114.959 -1.019 . . . . 0.56 111.392 -173.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.486 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 30.7 tt0 -62.5 -30.7 71.47 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.03 0.206 . . . . 1.26 111.195 -170.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.436 ' HA ' HE21 ' A' ' 13' ' ' GLN . 2.6 mm100 -73.19 -44.9 59.05 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.103 -0.702 . . . . 1.19 109.103 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.665 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.2 mp0 -62.49 -24.98 67.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.387 -0.824 . . . . 1.24 109.996 171.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 29' ' ' ASN . 12.2 mt -72.47 -35.23 68.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.227 -0.442 . . . . 0.2 110.077 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.591 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 27.1 mt-10 -67.07 -34.36 77.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.85 0.833 . . . . 0.88 109.639 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 20' ' ' SER . 9.2 tt0 -66.82 -46.8 74.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.497 178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 23' ' ' PHE . 52.4 mt -67.0 -32.5 73.78 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.918 0.866 . . . . 0.17 109.22 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.618 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.8 t30 -56.53 -28.21 59.47 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 113.976 -1.466 . . . . 0.25 110.524 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 17' ' ' GLN . 71.2 m -81.06 -19.56 43.49 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.92 -1.491 . . . . 0.66 110.112 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.5 mmm -98.75 3.79 47.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.18 -1.373 . . . . 1.41 110.55 -172.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.9 16.75 55.75 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.231 -0.895 . . . . 0.19 111.073 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 59.6 m-85 -108.01 104.28 13.69 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.362 0.601 . . . . 0.37 109.591 177.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.447 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -121.46 4.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.47 -0.786 . . . . 0.23 110.895 -175.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.474 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -78.47 81.8 4.78 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.59 -1.633 . . . . 1.84 106.59 171.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.764 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.0 mmp_? -43.01 -48.63 6.02 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.839 0.712 . . . . 1.63 110.926 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -45.73 -57.72 4.03 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.249 0.968 . . . . 2.44 111.161 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.474 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -63.73 -49.48 72.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.524 -0.307 . . . . 0.26 110.987 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.867 ' HB3' HD22 ' A' ' 15' ' ' LEU . 3.7 m-20 -48.28 -62.9 1.25 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 123.77 0.669 . . . . 0.14 111.551 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.4 pp -75.08 -24.48 58.16 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.173 -0.611 . . . . 0.27 112.294 -173.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.47 ' N ' HD12 ' A' ' 30' ' ' LEU . 10.1 mm100 -64.98 -32.64 74.47 Favored 'General case' 0 C--O 1.244 0.812 0 CA-C-O 122.057 0.932 . . . . 2.18 109.399 174.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.735 ' HA ' ' NH1' ' A' ' 46' ' ' ARG . . . -70.84 -38.19 73.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.314 -1.312 . . . . 0.12 107.835 177.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.0 OUTLIER -73.47 -21.8 60.33 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.719 -1.128 . . . . 0.2 111.596 176.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.698 HG13 ' O ' ' A' ' 30' ' ' LEU . 12.0 mt -68.29 -49.65 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 N-CA-C 109.801 -0.444 . . . . 0.34 109.801 176.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.558 ' HB3' ' NH1' ' A' ' 46' ' ' ARG . . . -76.66 -14.23 59.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.939 -0.573 . . . . 0.23 112.069 -178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.847 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 70.7 p -104.55 -18.25 14.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.757 -0.377 . . . . 0.17 111.694 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.16 35.04 87.95 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.51 -0.314 . . . . 0.29 113.372 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.1 10.47 36.67 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.325 -0.941 . . . . 0.37 111.364 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.847 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.2 t0 -94.09 87.14 5.2 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 106.241 -1.763 . . . . 0.64 106.241 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.761 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.74 -24.18 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 CA-C-N 114.644 -1.162 . . . . 0.52 111.058 -170.403 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -63.56 -52.2 62.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.716 -0.846 . . . . 1.29 108.716 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.72 -32.49 71.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.044 -0.98 . . . . 0.29 110.483 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -51.71 -51.71 53.93 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.573 0.225 . . . . 0.24 110.722 172.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.761 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.3 mt -61.32 -47.26 94.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 109.844 -0.428 . . . . 0.38 109.844 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.8 -20.67 65.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.414 . . . . 2.35 111.386 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.735 ' NH1' ' HA ' ' A' ' 32' ' ' ALA . 42.8 mtp180 -80.17 -34.67 37.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.883 0.373 . . . . 2.47 110.549 174.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.0 -35.87 66.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.32 0.581 . . . . 0.45 110.416 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.679 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 11.9 mt -82.13 -38.75 24.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.68 -0.691 . . . . 1.76 109.816 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -89.25 -46.54 4.37 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.038 -0.983 . . . . 1.28 112.86 -173.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -97.18 77.95 2.72 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.347 0.594 . . . . 4.31 110.63 -177.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -123.29 85.47 2.42 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.934 -1.135 . . . . 5.65 107.934 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -92.17 91.01 7.56 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.442 -1.254 . . . . 9.0 110.58 -171.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 m . . . . . 0 C--O 1.246 0.914 0 CA-C-N 114.993 -1.003 . . . . 10.04 109.671 179.234 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.83 0 N-CA-C 111.958 -0.457 . . . . 6.75 111.958 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -68.57 166.06 27.13 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.909 2.406 . . . . 6.37 111.628 175.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 2.0 pt? -67.39 100.36 0.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.488 0.661 . . . . 4.58 110.935 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.11 -137.85 32.18 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 114.88 -1.055 . . . . 1.5 112.755 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.0 m -113.89 53.55 0.78 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.437 0.637 . . . . 1.68 109.98 177.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.671 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 11.5 ptm -143.43 41.27 0.35 Allowed Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.809 -0.632 . . . . 2.28 111.914 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.671 ' HD3' ' N ' ' A' ' 6' ' ' MET . 4.9 Cg_endo -87.48 14.95 2.26 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.521 2.147 . . . . 0.92 112.966 -175.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.541 ' HB3' ' HB2' ' A' ' 12' ' ' GLN . 38.3 mt-10 -135.56 -15.08 1.89 Allowed 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.233 -0.654 . . . . 1.2 109.233 165.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.513 ' HB ' ' HB2' ' A' ' 6' ' ' MET . 59.2 t -62.48 -31.24 51.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.409 -0.814 . . . . 0.61 109.315 171.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 -101.53 -50.26 3.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.229 0.538 . . . . 2.74 110.069 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.789 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 9.8 m-85 -61.48 -54.79 38.66 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.744 -0.662 . . . . 0.56 111.845 -172.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.614 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 32.2 tt0 -59.72 -40.84 89.33 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.529 0.204 . . . . 1.26 111.197 -170.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -62.04 -48.0 82.21 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.499 0.666 . . . . 1.19 110.009 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.738 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.7 OUTLIER -66.45 -26.25 67.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.154 -0.93 . . . . 1.24 111.008 177.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.867 HD11 ' HB3' ' A' ' 30' ' ' LEU . 36.6 mt -73.35 -35.17 65.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.2 111.313 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 27.3 mt-10 -73.03 -27.15 61.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.558 0.694 . . . . 0.88 109.567 174.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.2 tt0 -65.09 -52.77 53.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.209 -0.905 . . . . 0.37 109.931 173.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.682 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 73.1 mt -62.49 -38.25 89.14 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-O 121.837 0.827 . . . . 0.17 108.982 176.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.3 t30 -49.87 -36.65 27.93 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 113.927 -1.488 . . . . 0.25 110.575 176.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 t -86.36 -19.3 29.97 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.949 -1.023 . . . . 0.66 110.227 -177.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.682 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 24.6 mmm -73.99 -19.97 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.122 -0.945 . . . . 1.41 110.016 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.24 15.63 15.44 Favored Glycine 0 N--CA 1.441 -1.011 0 N-CA-C 110.57 -1.012 . . . . 0.19 110.57 -172.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 65.8 m-85 -113.65 107.2 15.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.075 0.464 . . . . 0.37 110.206 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.476 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -124.84 8.9 4.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.898 -0.592 . . . . 0.23 110.847 -174.821 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.59 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -76.12 79.68 2.94 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.242 -1.392 . . . . 1.84 107.242 172.143 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.73 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -46.73 -45.83 19.9 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 123.66 0.6 . . . . 1.63 111.193 -173.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 31' ' ' GLN . 2.3 mp0 -55.68 -46.98 77.48 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.858 0.724 . . . . 2.44 110.442 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.59 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -70.39 -44.32 68.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.338 -0.392 . . . . 0.26 110.269 -179.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.668 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.2 m-20 -54.0 -64.16 0.92 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.551 -0.75 . . . . 0.14 111.089 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.9 OUTLIER -73.56 -25.32 60.32 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.287 -0.565 . . . . 0.27 111.794 -172.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -66.76 -28.56 68.5 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 118.542 0.61 . . . . 2.18 110.109 175.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.84 -32.9 62.05 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.928 -1.138 . . . . 0.12 107.928 177.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 11' ' ' PHE . 2.1 mp -76.82 -20.52 56.26 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.82 -1.082 . . . . 0.2 111.286 174.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 30' ' ' LEU . 23.9 mt -73.89 -38.99 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.129 -0.693 . . . . 0.34 109.129 176.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.81 -21.34 47.88 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.26 -0.882 . . . . 0.23 111.471 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 43.6 p -103.78 -18.74 14.55 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.922 0.391 . . . . 0.17 111.808 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.18 29.96 68.01 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.29 113.67 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.74 20.84 10.26 Favored Glycine 0 N--CA 1.441 -0.991 0 C-N-CA 120.085 -1.055 . . . . 0.37 111.969 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.516 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 10.7 t0 -104.1 89.63 3.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.837 -1.542 . . . . 0.64 106.837 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.23 -26.14 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 114.414 -1.267 . . . . 0.52 111.597 -168.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -50.02 71.49 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.668 -0.864 . . . . 1.29 108.668 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.09 -33.06 73.83 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.098 -0.956 . . . . 0.29 110.55 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.45 -49.27 67.74 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.676 -0.238 . . . . 0.24 111.017 172.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.809 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -65.01 -39.92 87.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 N-CA-C 109.919 -0.4 . . . . 0.38 109.919 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.0 -24.43 67.03 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-N 116.007 -0.542 . . . . 2.35 110.858 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 52.7 mtt180 -83.05 -33.37 26.46 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.862 -0.335 . . . . 2.47 110.855 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.35 -38.32 78.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.916 0.389 . . . . 0.45 111.144 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.517 HD23 HG22 ' A' ' 44' ' ' ILE . 3.5 mm? -88.86 -37.67 15.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.027 0.442 . . . . 1.76 110.707 176.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -81.17 -46.29 7.08 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.59 -0.814 . . . . 1.28 113.282 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.7 m -97.11 77.11 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.02 0.438 . . . . 4.31 110.501 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -111.25 85.13 2.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 122.094 0.949 . . . . 5.65 109.01 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -108.96 81.87 1.51 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.874 -1.057 . . . . 9.0 109.946 -175.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-N 115.037 -0.983 . . . . 10.04 110.576 -178.643 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 111.643 -0.583 . . . . 6.75 111.643 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.24 159.13 36.47 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.874 2.382 . . . . 6.37 111.72 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.7 mt -98.06 117.01 31.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.063 0.459 . . . . 4.58 111.233 -177.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.43 -11.94 65.69 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.668 -0.696 . . . . 1.5 111.438 172.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 m -88.07 48.44 1.64 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.798 0.809 . . . . 1.68 109.273 175.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 43.9 mtm -145.63 63.93 9.97 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 107.379 -1.341 . . . . 2.28 107.379 173.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -52.68 -38.71 77.04 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 123.253 2.635 . . . . 0.92 113.742 -168.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 26.8 mt-10 -85.97 3.9 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.527 -0.469 . . . . 1.2 112.157 -174.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.8 t -81.89 -25.41 9.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.968 -0.753 . . . . 0.61 108.968 170.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -100.78 -54.49 2.81 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.763 0.792 . . . . 2.74 109.13 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.661 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 16.5 m-30 -61.97 -55.47 29.04 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 114.81 -1.086 . . . . 0.56 111.462 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.547 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.5 tt0 -59.8 -33.28 71.52 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.836 -0.346 . . . . 1.26 111.642 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -62.83 -48.87 77.19 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.702 0.763 . . . . 1.19 109.403 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.508 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -68.89 -21.09 64.26 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.091 -0.959 . . . . 1.24 111.022 174.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.859 HD22 ' HB3' ' A' ' 29' ' ' ASN . 13.6 mt -74.37 -30.78 62.12 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 110.161 -0.311 . . . . 0.2 110.161 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.639 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 31.3 mt-10 -72.31 -30.0 64.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.886 0.85 . . . . 0.88 109.324 172.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 21' ' ' MET . 9.5 tt0 -66.44 -48.56 69.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.272 -0.876 . . . . 0.37 110.198 174.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.879 ' HG ' HD11 ' A' ' 40' ' ' ILE . 71.8 mt -68.73 -31.49 70.59 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.941 -0.763 . . . . 0.17 108.941 177.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.639 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 8.6 t30 -50.22 -37.21 34.35 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.202 -1.363 . . . . 0.25 109.817 173.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 t -86.68 -4.52 59.19 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.31 -1.314 . . . . 0.66 110.67 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.747 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 30.6 mtt -96.12 -9.2 31.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.542 0.687 . . . . 1.41 109.223 178.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.2 15.99 36.65 Favored Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.008 -0.996 . . . . 0.19 111.369 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.477 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 34.6 m-85 -108.84 110.64 22.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.411 0.624 . . . . 0.37 110.032 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.57 1.83 4.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 115.291 -0.868 . . . . 0.23 111.285 -174.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.477 ' ND2' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -72.05 78.05 0.93 Allowed 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 107.368 -1.345 . . . . 1.84 107.368 165.124 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 15.9 mmt85 -47.45 -35.3 8.36 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.964 -1.017 . . . . 1.63 109.95 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 35.9 mt-10 -53.31 -61.99 1.94 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.033 -0.985 . . . . 2.44 111.71 173.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.477 ' HB3' ' ND2' ' A' ' 25' ' ' ASN . . . -70.82 -37.0 73.19 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.064 -0.254 . . . . 0.26 110.598 -174.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.859 ' HB3' HD22 ' A' ' 15' ' ' LEU . 6.3 m-20 -49.67 -64.3 0.85 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.036 -0.529 . . . . 0.14 110.639 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.8 pp -74.74 -24.81 58.77 Favored 'General case' 0 C--O 1.212 -0.918 0 C-N-CA 119.852 -0.739 . . . . 0.27 112.323 -173.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.542 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.1 mm100 -61.25 -34.78 75.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.683 0.754 . . . . 2.18 109.406 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.71 -33.5 64.41 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.503 -1.226 . . . . 0.12 108.784 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.764 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -76.56 -20.76 56.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.326 -0.852 . . . . 0.2 110.975 175.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.755 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.4 mt -70.12 -41.25 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 109.118 -0.697 . . . . 0.34 109.118 174.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.93 -33.48 70.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.386 -0.825 . . . . 0.23 111.267 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.747 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 80.7 p -96.12 -18.81 19.86 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.956 0.354 . . . . 0.17 111.956 -177.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.68 33.02 56.59 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.29 112.717 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.764 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.45 10.8 56.59 Favored Glycine 0 CA--C 1.499 -0.951 0 C-N-CA 120.476 -0.869 . . . . 0.37 111.229 176.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.747 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.8 t70 -87.66 88.66 7.73 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 106.43 -1.693 . . . . 0.64 106.43 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.879 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -70.86 -22.4 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.025 -0.989 . . . . 0.52 111.738 -166.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.99 -51.41 66.94 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.611 -0.885 . . . . 1.29 108.611 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -65.8 -34.1 77.38 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.725 -1.125 . . . . 0.29 109.95 177.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 40' ' ' ILE . . . -58.75 -48.86 79.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.266 -0.424 . . . . 0.24 111.496 176.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.828 HG13 ' O ' ' A' ' 40' ' ' ILE . 7.0 mt -62.9 -45.77 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 N-CA-C 109.96 -0.385 . . . . 0.38 109.96 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HG2' ' HA ' ' A' ' 42' ' ' ALA . 9.3 pt-20 -69.26 -19.41 63.92 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.495 -0.482 . . . . 2.35 110.593 -177.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 48.0 mtt180 -78.17 -35.8 48.31 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 120.58 -0.448 . . . . 2.47 109.981 173.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.4 mt -64.81 -50.31 67.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.45 110.71 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.35 -38.23 50.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.229 -0.441 . . . . 1.76 110.688 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -75.27 -51.3 7.57 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.747 -0.74 . . . . 1.28 112.872 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.9 m -119.27 70.31 0.84 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.086 0.47 . . . . 4.31 110.151 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.407 ' HG2' ' H ' ' A' ' 51' ' ' GLN . 7.9 pt20 -79.84 84.9 5.56 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.231 -1.026 . . . . 5.65 108.231 172.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -106.11 83.66 1.93 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.925 -1.034 . . . . 9.0 110.883 -170.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 0.993 0 CA-C-N 115.156 -0.929 . . . . 10.04 109.59 178.35 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 N-CA-C 111.694 -0.563 . . . . 6.75 111.694 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.74 112.34 2.63 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.728 2.285 . . . . 6.37 111.929 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.454 ' O ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -60.55 110.4 1.27 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.831 0.824 . . . . 4.58 111.458 178.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.38 -34.25 4.4 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.383 -0.826 . . . . 1.5 112.616 176.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 64.4 m -85.58 52.35 2.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.484 0.659 . . . . 1.68 110.591 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.608 ' HE2' HG11 ' A' ' 9' ' ' VAL . 14.3 ptm -151.35 56.32 1.94 Allowed Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-N 115.356 -0.838 . . . . 2.28 109.112 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 6' ' ' MET . 16.3 Cg_exo -68.14 -43.03 5.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.942 2.428 . . . . 0.92 112.056 -170.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.739 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 40.9 tt0 -70.28 -20.03 63.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 1.2 110.057 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.608 HG11 ' HE2' ' A' ' 6' ' ' MET . 70.9 t -65.4 -32.25 57.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.896 -0.593 . . . . 0.61 110.161 174.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -90.16 -39.14 13.02 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.723 -0.843 . . . . 2.74 108.723 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.739 ' HB2' ' HA ' ' A' ' 8' ' ' GLU . 9.7 m-30 -61.2 -50.74 71.88 Favored 'General case' 0 C--O 1.214 -0.801 0 CA-C-N 114.515 -1.22 . . . . 0.56 109.92 -178.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.0 tt0 -56.01 -39.46 71.95 Favored 'General case' 0 C--O 1.224 -0.272 0 O-C-N 123.207 0.317 . . . . 1.26 111.389 -177.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -63.37 -44.86 93.58 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.671 0.748 . . . . 1.19 109.502 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.672 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.0 OUTLIER -73.66 -19.28 60.88 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.189 -0.914 . . . . 1.24 111.216 175.166 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.9 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.6 mt -77.88 -36.24 49.94 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 110.04 -0.355 . . . . 0.2 110.04 -178.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 29.0 mt-10 -70.79 -29.02 65.1 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.77 0.669 . . . . 0.88 109.64 172.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -66.28 -51.7 54.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.37 110.045 174.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.872 ' HG ' HD11 ' A' ' 40' ' ' ILE . 79.5 mt -63.61 -34.74 78.5 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.938 0.875 . . . . 0.17 108.885 176.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.625 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 5.2 t30 -53.19 -34.87 58.81 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.902 -1.499 . . . . 0.25 110.266 175.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.4 t -86.8 -12.01 49.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.625 -1.17 . . . . 0.66 110.01 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.9 mmm -90.86 -5.55 55.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.266 -0.879 . . . . 1.41 109.892 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.17 15.99 39.61 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.323 -0.853 . . . . 0.19 111.195 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.503 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.4 m-85 -111.42 107.41 16.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.135 0.493 . . . . 0.37 109.771 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.485 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -127.29 8.44 3.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.802 -0.635 . . . . 0.23 111.322 -173.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.425 HD22 ' HB2' ' A' ' 27' ' ' GLU . 1.1 t30 -82.96 85.7 7.1 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 106.423 -1.695 . . . . 1.84 106.423 170.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.836 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 11.2 mmp_? -42.81 -47.52 5.53 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 124.069 0.856 . . . . 1.63 110.555 -177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.425 ' HB2' HD22 ' A' ' 25' ' ' ASN . 35.6 mt-10 -44.39 -57.1 3.73 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.587 1.18 . . . . 2.44 111.275 175.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.5 -47.09 64.99 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.888 0.375 . . . . 0.26 110.347 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.804 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.7 -65.03 0.64 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.162 -0.926 . . . . 0.14 111.556 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.9 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.7 pp -73.15 -28.11 62.05 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 119.126 -0.464 . . . . 0.27 111.969 -172.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.56 ' N ' HD12 ' A' ' 30' ' ' LEU . 18.5 mt-30 -60.09 -37.02 78.71 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.731 0.776 . . . . 2.18 109.678 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -72.17 -31.67 66.14 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.363 -1.29 . . . . 0.12 108.814 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.768 HD23 ' HA2' ' A' ' 38' ' ' GLY . 2.1 mp -79.33 -19.59 49.98 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.218 -0.901 . . . . 0.2 111.17 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.1 mt -71.09 -44.18 75.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.777 -0.823 . . . . 0.34 108.777 173.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.97 -27.21 66.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.202 -0.908 . . . . 0.23 111.287 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.832 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 54.7 p -101.73 -19.38 15.4 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.53 0.567 . . . . 0.17 112.53 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.52 26.12 72.53 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.06 -0.59 . . . . 0.29 112.201 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.768 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 98.44 18.76 25.07 Favored Glycine 0 CA--C 1.5 -0.855 0 C-N-CA 120.66 -0.781 . . . . 0.37 111.472 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.832 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 18.4 t70 -94.04 87.87 5.48 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.395 -1.705 . . . . 0.64 106.395 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.872 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.5 OUTLIER -68.94 -23.92 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 114.849 -1.068 . . . . 0.52 110.923 -166.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 60.3 m-20 -52.51 -57.39 10.07 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.25 0.548 . . . . 1.29 109.717 173.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' A' ' 45' ' ' GLU . . . -72.55 -22.32 61.03 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.319 -0.855 . . . . 0.29 111.09 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.445 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -58.23 -48.63 79.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 121.162 -0.215 . . . . 0.24 110.585 168.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.449 HD13 ' CE ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -70.74 -32.98 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 120.544 -0.462 . . . . 0.38 110.753 177.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 6.9 mm-40 -61.61 -22.72 65.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.087 0.47 . . . . 2.35 110.098 174.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -88.76 -44.59 10.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.954 -0.566 . . . . 2.47 111.195 175.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 82.4 mt -62.66 -37.84 87.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.855 0.359 . . . . 0.45 111.678 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 48' ' ' LEU . 3.6 mm? -96.03 -35.89 11.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.129 -0.487 . . . . 1.76 111.149 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -85.46 -45.87 5.69 Favored Glycine 0 CA--C 1.51 -0.261 0 C-N-CA 120.39 -0.91 . . . . 1.28 112.494 -174.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.2 m -95.56 75.33 3.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.424 0.631 . . . . 4.31 110.086 -178.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -106.89 85.14 2.09 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 121.949 0.88 . . . . 5.65 108.67 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.6 81.57 1.92 Allowed 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.873 -1.058 . . . . 9.0 110.541 -174.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.001 -0.999 . . . . 10.04 108.974 175.924 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.68 0 N-CA-C 111.589 -0.604 . . . . 6.75 111.589 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.74 146.13 26.37 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.786 2.324 . . . . 6.37 111.04 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 1.4 pt? -121.25 112.54 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.363 0.601 . . . . 4.58 110.664 -178.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.54 4.56 72.75 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.284 -0.871 . . . . 1.5 111.841 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.8 m -85.73 47.35 1.43 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 122.119 0.962 . . . . 1.68 109.447 178.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.427 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 33.0 mtm -146.26 59.23 5.23 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 106.848 -1.538 . . . . 2.28 106.848 173.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.54 -38.97 90.27 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.95 2.433 . . . . 0.92 112.766 -166.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.946 ' HG2' ' HB2' ' A' ' 12' ' ' GLN . 4.7 tt0 -82.06 -9.0 59.69 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.651 -0.42 . . . . 1.2 110.97 -172.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.427 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 87.9 t -69.43 -29.66 42.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.424 0.63 . . . . 0.61 109.512 174.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -92.83 -49.51 6.02 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.76 -0.83 . . . . 2.74 108.76 173.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.786 ' HA ' HD22 ' A' ' 33' ' ' LEU . 17.7 m-30 -62.55 -55.28 28.78 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 114.937 -1.029 . . . . 0.56 111.968 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.946 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 50.8 tt0 -56.97 -42.43 80.16 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 111.778 0.288 . . . . 1.26 111.778 -172.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 13' ' ' GLN . 20.0 mm-40 -60.17 -45.75 92.01 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.649 0.737 . . . . 1.19 110.181 178.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.724 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -72.77 -21.0 61.07 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.892 -1.049 . . . . 1.24 111.444 176.348 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.854 HD22 ' HB3' ' A' ' 29' ' ' ASN . 11.8 mt -73.73 -37.6 65.06 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.267 -0.271 . . . . 0.2 110.267 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 29.8 mt-10 -69.68 -28.7 66.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.721 0.772 . . . . 0.88 109.376 174.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 21' ' ' MET . 9.1 tt0 -67.51 -46.33 73.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.167 -0.924 . . . . 0.37 110.407 174.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.541 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 42.6 mt -67.56 -31.9 72.29 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 122.082 0.944 . . . . 0.17 108.914 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.558 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.3 t30 -57.07 -30.5 64.34 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 113.633 -1.621 . . . . 0.25 109.966 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -83.11 -19.8 36.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.478 -1.237 . . . . 0.66 109.9 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.541 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 13.3 mmt -80.18 -17.55 52.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.135 -0.939 . . . . 1.41 109.889 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.25 13.45 28.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.391 -1.083 . . . . 0.19 110.391 -171.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.432 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.6 m-85 -105.14 108.89 20.65 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.298 0.57 . . . . 0.37 110.856 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -125.33 13.02 4.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.627 -0.715 . . . . 0.23 111.367 -174.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 3.2 t30 -84.99 80.25 9.36 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 106.736 -1.579 . . . . 1.84 106.736 173.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.771 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.1 mmp_? -43.18 -49.23 6.53 Favored 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.934 0.771 . . . . 1.63 111.322 -174.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -47.73 -55.93 8.46 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 124.602 1.189 . . . . 2.44 110.537 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.542 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -66.75 -46.91 73.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.144 -0.48 . . . . 0.26 110.744 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.854 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.4 m-20 -48.05 -64.23 0.85 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.641 -0.709 . . . . 0.14 111.31 177.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.6 pp -71.84 -27.31 62.81 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 120.376 -0.53 . . . . 0.27 111.976 -174.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.504 ' N ' HD12 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.03 -30.85 71.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.348 0.594 . . . . 2.18 109.93 176.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.88 -32.89 61.98 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.574 -0.899 . . . . 0.12 108.574 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' ' 11' ' ' PHE . 1.9 mp -73.95 -23.7 59.54 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.21 -0.905 . . . . 0.2 111.334 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.76 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.4 mt -72.18 -37.55 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.278 -0.638 . . . . 0.34 109.278 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.8 -27.5 60.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.723 -0.671 . . . . 0.23 111.305 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.672 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 66.0 p -99.95 -17.96 17.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.298 -0.41 . . . . 0.17 111.696 -177.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.99 29.77 70.5 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.29 113.056 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.03 22.0 10.44 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 119.979 -1.105 . . . . 0.37 111.48 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.672 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t0 -104.51 89.09 3.11 Favored 'General case' 0 CA--C 1.499 -1.011 0 N-CA-C 106.597 -1.631 . . . . 0.64 106.597 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.711 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -66.95 -25.14 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 CA-C-N 114.374 -1.285 . . . . 0.52 111.599 -168.316 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.18 -49.34 74.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.579 -0.897 . . . . 1.29 108.579 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.624 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -67.95 -33.43 74.64 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.851 -1.068 . . . . 0.29 110.077 177.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.49 67.65 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 111.376 0.139 . . . . 0.24 111.376 173.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -40.14 87.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 CA-C-O 120.744 0.306 . . . . 0.38 110.226 178.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -67.9 -19.62 65.02 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.233 -0.44 . . . . 2.35 110.585 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 57.3 mtp85 -77.79 -47.73 18.24 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.158 -0.617 . . . . 2.47 109.597 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.462 HD11 HD13 ' A' ' 18' ' ' LEU . 24.3 mt -70.07 -44.82 68.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.272 -0.876 . . . . 0.45 111.485 -177.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.01 -36.35 18.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.313 -0.858 . . . . 1.76 110.369 -172.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -79.23 -57.17 3.24 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.248 -0.977 . . . . 1.28 111.983 -176.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.1 m -86.62 80.51 8.56 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.379 0.609 . . . . 4.31 109.42 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -110.93 84.8 1.99 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 122.25 1.024 . . . . 5.65 108.941 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 mp -106.47 85.86 2.25 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 114.817 -1.083 . . . . 9.0 110.108 -173.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.118 -0.944 . . . . 10.04 109.476 178.436 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.404 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 111.887 -0.485 . . . . 6.75 111.887 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.404 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 17.2 Cg_exo -67.8 156.39 66.16 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 123.133 2.556 . . . . 6.37 112.287 178.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 pp -120.58 126.6 50.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.076 -0.511 . . . . 4.58 110.367 178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.43 -33.83 2.04 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.687 -0.688 . . . . 1.5 113.245 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.8 m -80.0 55.28 2.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.637 0.732 . . . . 1.68 110.435 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.632 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 1.1 ppp? -153.32 46.22 0.32 Allowed Pre-proline 0 N--CA 1.439 -1.014 0 CA-C-N 114.894 -1.048 . . . . 2.28 108.874 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.632 ' HD3' ' N ' ' A' ' 6' ' ' MET . 16.0 Cg_exo -65.68 -47.47 3.95 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 122.15 1.9 . . . . 0.92 111.503 -171.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.693 ' HA ' ' HB2' ' A' ' 11' ' ' PHE . 20.7 mt-10 -73.69 -12.89 60.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.942 -0.572 . . . . 1.2 111.229 -178.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 6' ' ' MET . 87.1 t -63.08 -27.27 42.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.986 -0.746 . . . . 0.61 108.986 170.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -102.4 -47.94 4.32 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.663 0.744 . . . . 2.74 110.001 172.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.693 ' HB2' ' HA ' ' A' ' 8' ' ' GLU . 12.5 m-30 -62.39 -54.91 33.43 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 115.005 -0.998 . . . . 0.56 112.204 -174.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.567 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 8.8 tt0 -58.84 -36.87 75.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.197 -0.201 . . . . 1.26 111.049 -173.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -64.18 -41.46 97.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.813 0.816 . . . . 1.19 109.937 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.79 ' HB3' HG13 ' A' ' 40' ' ' ILE . 33.4 mt-30 -74.98 -21.12 59.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.118 -0.946 . . . . 1.24 110.931 175.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 30' ' ' LEU . 20.1 mt -75.46 -36.67 60.65 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.591 -0.277 . . . . 0.2 110.317 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.567 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.6 mt-10 -73.43 -26.02 60.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.499 0.666 . . . . 0.88 109.975 174.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.97 -50.87 60.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.267 -0.878 . . . . 0.37 109.723 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.852 ' HG ' HD11 ' A' ' 40' ' ' ILE . 33.0 mt -63.37 -34.71 78.31 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.9 0.857 . . . . 0.17 109.135 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 5.4 t30 -53.92 -34.93 60.99 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.031 -1.441 . . . . 0.25 110.275 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 t -87.23 -6.2 58.66 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.558 -1.201 . . . . 0.66 109.822 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.564 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 7.2 mmm -98.33 -4.72 34.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.966 -1.016 . . . . 1.41 109.864 -178.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.69 18.23 33.24 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.3 -0.864 . . . . 0.19 111.295 -177.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.513 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 60.8 m-85 -113.4 109.32 18.5 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.116 0.484 . . . . 0.37 109.764 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.529 ' HA ' ' NH2' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -126.98 0.88 3.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.054 -0.521 . . . . 0.23 111.596 -172.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.69 82.31 3.32 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 107.117 -1.438 . . . . 1.84 107.117 171.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.794 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 10.5 mmp_? -41.64 -49.0 4.19 Favored 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 124.011 0.819 . . . . 1.63 110.933 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLN . 2.4 mm-40 -43.59 -58.57 2.58 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.729 1.268 . . . . 2.44 110.588 176.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.83 -49.23 63.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.26 110.723 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.797 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.1 m-20 -45.55 -64.25 0.77 Allowed 'General case' 0 C--O 1.234 0.249 0 O-C-N 123.745 0.653 . . . . 0.14 111.385 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.1 pp -72.99 -27.01 61.55 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-O 119.006 -0.521 . . . . 0.27 112.189 -173.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.509 ' N ' HD12 ' A' ' 30' ' ' LEU . 23.6 mm-40 -60.78 -35.33 76.16 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.711 0.767 . . . . 2.18 109.389 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.469 ' HB1' ' HA ' ' A' ' 43' ' ' ALA . . . -73.12 -33.16 65.38 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.563 -1.199 . . . . 0.12 108.718 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.62 HD21 ' CB ' ' A' ' 14' ' ' GLN . 2.3 mp -75.84 -25.61 56.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.164 -0.926 . . . . 0.2 111.387 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 30' ' ' LEU . 5.3 mt -73.99 -32.71 34.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.394 0.616 . . . . 0.34 109.391 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.624 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -79.55 -23.54 42.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.455 -0.793 . . . . 0.23 111.139 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 45.7 p -104.79 -17.98 14.41 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.214 0.45 . . . . 0.17 112.214 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.72 32.21 70.61 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 121.408 -0.425 . . . . 0.29 113.051 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.93 37.88 5.06 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 119.884 -1.15 . . . . 0.37 111.43 176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.458 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.9 t70 -119.38 87.11 2.68 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 106.119 -1.808 . . . . 0.64 106.119 172.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.868 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -65.55 -24.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.557 0 CA-C-N 113.836 -1.529 . . . . 0.52 111.644 -166.597 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -62.03 -50.44 72.01 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.938 -0.764 . . . . 1.29 108.938 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.584 ' O ' ' HG3' ' A' ' 45' ' ' GLU . . . -68.88 -32.13 71.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.876 -1.056 . . . . 0.29 110.367 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.523 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -56.14 -49.85 72.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 121.26 -0.176 . . . . 0.24 110.882 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.868 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.6 mt -63.29 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.699 0.285 . . . . 0.38 110.812 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.584 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -72.99 -19.6 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.745 -0.382 . . . . 2.35 110.585 -176.3 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.624 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 75.3 mtt180 -84.85 -27.11 26.95 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.974 0.416 . . . . 2.47 110.409 173.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 43' ' ' ALA . 96.2 mt -70.14 -44.22 69.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 0.45 110.071 174.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.45 -35.86 80.04 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.315 -0.857 . . . . 1.76 109.318 170.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.83 71.96 0.96 Allowed Glycine 0 CA--C 1.496 -1.11 0 N-CA-C 110.603 -0.999 . . . . 1.28 110.603 -177.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.1 m -32.53 100.34 0.02 OUTLIER 'General case' 0 C--O 1.233 0.186 0 O-C-N 125.11 1.124 . . . . 4.31 112.403 -177.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -110.98 89.55 3.08 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.661 -1.154 . . . . 5.65 108.971 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.25 92.32 3.72 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.243 -0.89 . . . . 9.0 110.627 -174.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.254 1.335 0 CA-C-N 113.944 -1.48 . . . . 10.04 110.286 177.14 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.406 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.943 -0.463 . . . . 6.75 111.943 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 3.8 Cg_exo -79.16 160.44 26.54 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 6.37 111.772 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.2 mt -76.94 100.29 5.53 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.996 -0.547 . . . . 4.58 111.207 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.69 -2.56 22.54 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.697 -0.763 . . . . 1.5 111.45 172.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.7 m -84.67 50.81 1.98 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.717 0.77 . . . . 1.68 110.062 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.512 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 25.2 mtm -145.75 56.59 3.51 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.176 -0.92 . . . . 2.28 108.894 177.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 6' ' ' MET . 34.9 Cg_exo -60.13 -36.83 87.45 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.251 1.968 . . . . 0.92 112.229 -170.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 29.8 mt-10 -82.99 -11.53 58.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.2 111.315 -176.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.512 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 98.4 t -75.3 -21.03 16.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.654 0.74 . . . . 0.61 109.422 174.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -102.78 -55.81 2.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.581 0.705 . . . . 2.74 109.156 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.806 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.2 m-30 -61.54 -54.6 40.93 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.849 -1.069 . . . . 0.56 111.375 -172.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.616 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 9.9 tt0 -59.54 -34.34 72.52 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 121.235 -0.186 . . . . 1.26 111.492 -172.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.02 -47.42 77.5 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.578 0.704 . . . . 1.19 109.427 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.752 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 1.1 mp0 -69.6 -19.28 63.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.282 -0.872 . . . . 1.24 111.203 174.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.641 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.5 mt -73.75 -40.2 63.67 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.621 -0.511 . . . . 0.2 109.621 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 33.3 mt-10 -64.54 -31.35 72.53 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.827 0.822 . . . . 0.88 109.59 173.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.51 ' NE2' HG21 ' A' ' 40' ' ' ILE . 8.1 tt0 -66.83 -50.63 61.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.096 -0.956 . . . . 0.37 111.056 175.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.681 ' HG ' HD11 ' A' ' 40' ' ' ILE . 62.0 mt -66.37 -30.15 70.47 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.854 0.835 . . . . 0.17 108.871 177.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.9 t30 -54.23 -35.29 62.3 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.051 -1.431 . . . . 0.25 110.3 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 t -87.1 -3.74 59.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.727 -1.124 . . . . 0.66 110.027 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.619 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 31.6 mmm -97.48 -8.38 29.38 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.306 -0.861 . . . . 1.41 109.718 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.28 16.89 33.39 Favored Glycine 0 N--CA 1.442 -0.954 0 CA-C-N 115.27 -0.877 . . . . 0.19 111.153 -176.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.52 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 55.3 m-85 -110.63 109.52 19.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.37 109.879 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.76 -8.06 10.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.764 -0.653 . . . . 0.23 111.43 -172.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -73.13 83.14 1.3 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.94 -1.504 . . . . 1.84 106.94 169.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.89 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 57.2 mtt85 -60.98 -26.01 67.26 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.218 -0.446 . . . . 1.63 110.717 -175.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -52.76 -50.5 63.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.433 -0.58 . . . . 2.44 109.433 168.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.52 -46.26 60.14 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.987 -0.551 . . . . 0.26 110.421 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' CB ' HD22 ' A' ' 15' ' ' LEU . 6.6 m-20 -50.82 -60.41 3.09 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.659 -0.701 . . . . 0.14 111.268 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.89 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 2.0 pp -73.87 -24.22 59.71 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 120.294 -0.563 . . . . 0.27 112.343 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.546 ' N ' HD12 ' A' ' 30' ' ' LEU . 17.4 mm-40 -60.85 -34.66 74.93 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.88 0.848 . . . . 2.18 109.328 172.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.02 -31.17 61.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.285 -1.325 . . . . 0.12 108.176 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.806 HD22 ' HA ' ' A' ' 11' ' ' PHE . 0.9 OUTLIER -79.68 -22.06 43.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.166 -0.925 . . . . 0.2 111.233 177.289 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.752 HG13 ' O ' ' A' ' 30' ' ' LEU . 6.0 mt -73.33 -38.5 53.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.641 -0.503 . . . . 0.34 109.641 175.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.6 -22.16 54.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.852 -0.613 . . . . 0.23 111.152 179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.476 ' OG1' ' HA ' ' A' ' 33' ' ' LEU . 46.4 p -102.86 -18.78 14.93 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.338 0.496 . . . . 0.17 112.338 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.93 28.86 59.94 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 121.343 -0.456 . . . . 0.29 113.241 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.748 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 103.07 10.17 37.54 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.103 -1.046 . . . . 0.37 111.487 176.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.474 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 14.3 t70 -96.52 87.88 4.53 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 107.117 -1.438 . . . . 0.64 107.117 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.8 ' O ' HG13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -64.59 -25.72 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-N 114.11 -1.404 . . . . 0.52 111.536 -169.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 5.5 m-80 -60.51 -53.91 51.8 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.829 -0.804 . . . . 1.29 108.829 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -68.26 -30.9 70.04 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.437 -0.801 . . . . 0.29 110.559 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -46.32 74.0 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.395 -0.366 . . . . 0.24 110.543 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.8 HG13 ' O ' ' A' ' 40' ' ' ILE . 4.0 mt -68.13 -37.53 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 109.892 -0.41 . . . . 0.38 109.892 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 41' ' ' ASN . 51.0 mt-10 -65.7 -21.12 66.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.93 -0.577 . . . . 2.35 110.935 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 54.1 mtt180 -87.33 -40.95 14.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.312 -0.404 . . . . 2.47 110.845 176.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -47.57 85.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.995 0.426 . . . . 0.45 110.685 177.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.466 HD23 HG22 ' A' ' 44' ' ' ILE . 4.3 mm? -72.66 -32.41 65.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.929 -0.578 . . . . 1.76 109.842 173.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 68.14 72.27 0.84 Allowed Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.737 -0.945 . . . . 1.28 110.737 -178.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.2 m -35.13 99.21 0.02 OUTLIER 'General case' 0 C--O 1.233 0.206 0 O-C-N 125.189 1.17 . . . . 4.31 111.89 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -109.6 86.56 2.32 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.797 -1.092 . . . . 5.65 109.249 -177.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mp -124.18 84.77 2.32 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.011 -0.995 . . . . 9.0 109.626 -176.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.481 -0.781 . . . . 10.04 110.028 -175.632 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 111.648 -0.581 . . . . 6.75 111.648 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -78.24 126.37 7.67 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.364 2.043 . . . . 6.37 112.779 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -111.35 110.09 20.39 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.499 0.666 . . . . 4.58 109.33 174.155 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -121.11 -16.79 4.26 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.457 -0.878 . . . . 1.5 111.945 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 m -115.1 51.17 0.93 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.536 0.684 . . . . 1.68 110.544 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.592 ' HE2' HG11 ' A' ' 9' ' ' VAL . 73.7 mtp -138.37 56.34 10.06 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 2.28 108.691 172.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 6' ' ' MET . 35.5 Cg_exo -60.87 -57.39 0.65 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.827 2.351 . . . . 0.92 112.451 -168.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.74 ' HG2' ' HB2' ' A' ' 12' ' ' GLN . 21.7 tt0 -82.31 1.81 35.1 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.393 0.616 . . . . 1.2 110.215 -170.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.592 HG11 ' HE2' ' A' ' 6' ' ' MET . 93.3 t -78.65 -31.85 15.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.582 -0.735 . . . . 0.61 109.217 173.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -101.65 -39.85 7.27 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.682 -0.69 . . . . 2.74 110.151 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.651 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 17.2 m-30 -61.44 -54.55 42.02 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 115.238 -0.892 . . . . 0.56 110.318 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.74 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 8.6 tt0 -55.78 -35.56 66.39 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 123.368 0.417 . . . . 1.26 111.51 -175.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -64.56 -49.65 70.38 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.566 0.698 . . . . 1.19 109.267 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.506 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -68.75 -19.04 64.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.147 -0.933 . . . . 1.24 111.038 174.378 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 30' ' ' LEU . 11.3 mt -75.97 -35.85 59.49 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 122.027 -0.42 . . . . 0.2 110.083 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 30.7 mt-10 -71.93 -25.6 61.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.538 0.685 . . . . 0.88 109.362 173.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.408 HE21 HD12 ' A' ' 40' ' ' ILE . 9.7 tt0 -70.01 -46.28 65.44 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.444 -0.798 . . . . 0.37 110.569 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.886 ' HG ' HD11 ' A' ' 40' ' ' ILE . 63.7 mt -69.47 -33.56 73.08 Favored 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.281 -1.007 . . . . 0.17 108.281 177.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.603 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 6.1 t30 -51.8 -35.01 42.58 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.482 -1.69 . . . . 0.25 110.146 173.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.6 t -86.57 -11.1 52.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.592 -1.186 . . . . 0.66 110.378 -178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.651 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 2.2 mmm -90.45 -13.26 35.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.716 -0.675 . . . . 1.41 110.204 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.02 13.32 27.49 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-N 115.386 -0.825 . . . . 0.19 111.349 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.423 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m-85 -111.12 107.96 17.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.244 0.545 . . . . 0.37 110.392 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.49 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -123.79 6.22 5.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.94 -0.573 . . . . 0.23 111.37 -174.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.484 ' ND2' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -75.9 79.16 2.8 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.383 -1.339 . . . . 1.84 107.383 167.437 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.795 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 9.0 mmt85 -46.36 -39.48 10.4 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.574 -0.739 . . . . 1.63 109.926 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -46.94 -62.19 1.52 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.649 -1.16 . . . . 2.44 111.429 172.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.484 ' HB3' ' ND2' ' A' ' 25' ' ' ASN . . . -72.77 -39.69 66.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.802 -0.359 . . . . 0.26 110.76 -175.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.786 ' HB3' HD22 ' A' ' 15' ' ' LEU . 7.3 m-20 -49.34 -64.95 0.66 Allowed 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 123.284 0.365 . . . . 0.14 111.082 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.895 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.3 pp -74.98 -26.53 59.64 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 119.835 -0.746 . . . . 0.27 112.364 -171.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.595 ' N ' HD12 ' A' ' 30' ' ' LEU . 23.4 mt-30 -63.65 -33.3 75.32 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.763 0.792 . . . . 2.18 109.661 176.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.45 67.23 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.499 -1.228 . . . . 0.12 108.541 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.745 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -74.78 -23.24 58.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.316 -0.857 . . . . 0.2 110.935 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.773 HG13 ' O ' ' A' ' 30' ' ' LEU . 21.6 mt -70.72 -36.85 66.75 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.649 0.738 . . . . 0.34 109.246 175.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.593 ' HB1' ' NH1' ' A' ' 46' ' ' ARG . . . -78.65 -20.52 50.08 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.055 -0.975 . . . . 0.23 111.501 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 63.3 p -108.36 -19.1 13.58 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.852 -0.339 . . . . 0.17 111.817 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.8 26.46 58.54 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 121.473 -0.394 . . . . 0.29 112.908 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.745 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 97.69 16.87 32.47 Favored Glycine 0 CA--C 1.497 -1.059 0 C-N-CA 120.2 -1.0 . . . . 0.37 111.311 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.621 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 9.0 t70 -93.13 93.06 8.08 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 105.405 -2.072 . . . . 0.64 105.405 170.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.886 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.77 -25.05 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-N 114.862 -1.063 . . . . 0.52 111.355 -166.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -59.52 -52.03 67.29 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.295 -0.631 . . . . 1.29 109.295 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' GLU . . . -69.8 -27.18 64.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.318 -0.855 . . . . 0.29 110.288 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.497 ' O ' ' HG ' ' A' ' 47' ' ' LEU . . . -61.65 -49.2 77.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.24 110.859 173.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.83 HG13 ' O ' ' A' ' 40' ' ' ILE . 2.6 mt -65.88 -38.63 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 120.685 0.278 . . . . 0.38 110.264 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 42' ' ' ALA . 6.4 pt-20 -66.71 -24.24 66.22 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.905 -0.318 . . . . 2.35 110.487 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.593 ' NH1' ' HB1' ' A' ' 35' ' ' ALA . 61.0 mtt180 -82.17 -29.67 31.41 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.626 -0.43 . . . . 2.47 110.091 175.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 44' ' ' ILE . 91.4 mt -66.14 -49.09 68.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.263 -0.426 . . . . 0.45 110.808 177.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -83.47 -34.93 25.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.092 0.472 . . . . 1.76 110.679 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -72.56 -45.34 36.95 Favored Glycine 0 N--CA 1.444 -0.807 0 CA-C-N 115.468 -0.787 . . . . 1.28 113.07 -174.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.5 m -85.36 74.58 10.36 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.373 0.606 . . . . 4.31 109.977 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -107.94 86.03 2.22 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.758 0.789 . . . . 5.65 109.156 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -119.58 85.18 2.33 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.307 -0.86 . . . . 9.0 110.217 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.246 0.913 0 CA-C-N 114.85 -1.068 . . . . 10.04 108.918 177.863 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 N-CA-C 111.804 -0.518 . . . . 6.75 111.804 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -63.5 166.65 14.84 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.851 2.367 . . . . 6.37 112.366 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.433 HD22 ' SD ' ' A' ' 6' ' ' MET . 75.3 mt -81.79 98.97 8.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.996 -0.547 . . . . 4.58 111.625 -177.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.32 -8.79 1.28 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.234 -0.893 . . . . 1.5 111.014 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.9 m -89.76 49.83 1.79 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.811 0.815 . . . . 1.68 109.719 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.537 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 16.6 mtm -139.96 50.13 2.22 Favored Pre-proline 0 N--CA 1.448 -0.541 0 CA-C-N 114.853 -1.067 . . . . 2.28 109.379 177.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 6' ' ' MET . 37.8 Cg_exo -58.76 -41.72 60.42 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 121.817 1.678 . . . . 0.92 112.038 -171.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.412 ' HB3' ' HB2' ' A' ' 12' ' ' GLN . 28.7 mt-10 -83.47 -11.57 57.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.736 -0.386 . . . . 1.2 111.373 -175.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.463 ' CG2' ' HB3' ' A' ' 6' ' ' MET . 81.2 t -67.42 -28.61 42.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.515 0.674 . . . . 0.61 109.297 173.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 -99.11 -56.66 2.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.684 -0.689 . . . . 2.74 109.793 172.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.731 ' HA ' HD22 ' A' ' 33' ' ' LEU . 18.3 m-30 -62.36 -55.21 30.23 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.308 -0.86 . . . . 0.56 111.679 -171.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.584 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 29.4 tt0 -58.68 -37.49 76.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 117.931 0.332 . . . . 1.26 110.979 -171.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -59.8 -52.07 67.04 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 122.212 1.006 . . . . 1.19 109.395 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.687 ' HG2' ' HB ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -70.24 -20.04 63.1 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.182 -1.372 . . . . 1.24 111.365 178.289 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 30' ' ' LEU . 13.0 mt -74.92 -35.09 62.2 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 122.348 -0.22 . . . . 0.2 110.652 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB3' ' A' ' 19' ' ' ASN . 34.3 mt-10 -70.68 -29.84 66.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.786 0.803 . . . . 0.88 109.18 173.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.402 ' HB3' ' O ' ' A' ' 14' ' ' GLN . 9.3 tt0 -66.28 -48.14 71.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.976 -1.011 . . . . 0.37 110.489 175.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.873 ' HG ' HD11 ' A' ' 40' ' ' ILE . 67.1 mt -69.59 -31.86 70.26 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.849 -0.797 . . . . 0.17 108.849 177.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.64 ' HB3' ' O ' ' A' ' 16' ' ' GLU . 6.7 t30 -50.92 -34.35 28.12 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.181 -1.372 . . . . 0.25 110.062 173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.2 t -86.71 -14.96 40.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.415 -1.266 . . . . 0.66 110.61 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.829 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 23.5 mtt -85.41 -10.76 55.78 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.488 0.661 . . . . 1.41 109.961 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.34 10.91 43.5 Favored Glycine 0 N--CA 1.439 -1.129 0 N-CA-C 110.808 -0.917 . . . . 0.19 110.808 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.467 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 49.0 m-85 -107.73 109.32 20.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.582 0.706 . . . . 0.37 110.625 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.456 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -126.53 9.8 3.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 115.554 -0.748 . . . . 0.23 111.063 -174.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.585 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 2.3 t30 -79.34 79.8 5.76 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 106.882 -1.525 . . . . 1.84 106.882 172.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.769 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 58.7 mmt-85 -46.04 -44.46 15.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.891 0.745 . . . . 1.63 111.948 -171.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.6 -49.98 75.67 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.514 0.508 . . . . 2.44 110.304 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -64.06 -47.77 78.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.18 -0.304 . . . . 0.26 110.18 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.773 ' HB3' HD22 ' A' ' 15' ' ' LEU . 5.5 m-20 -48.48 -63.46 1.08 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.656 -0.702 . . . . 0.14 111.036 176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.808 ' HB3' HD11 ' A' ' 15' ' ' LEU . 2.2 pp -73.8 -25.46 60.13 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 120.307 -0.557 . . . . 0.27 112.395 -172.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.572 ' N ' HD12 ' A' ' 30' ' ' LEU . 13.6 mt-30 -64.32 -32.48 74.1 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.753 0.787 . . . . 2.18 109.848 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -73.4 -33.46 64.99 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.861 -1.063 . . . . 0.12 108.591 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.8 HD23 ' HA2' ' A' ' 38' ' ' GLY . 1.3 mp -75.19 -24.61 57.85 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.09 -0.959 . . . . 0.2 110.991 175.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.779 HG13 ' O ' ' A' ' 30' ' ' LEU . 26.4 mt -67.75 -48.29 76.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.363 -0.606 . . . . 0.34 109.363 175.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.4 -28.0 68.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.432 -0.804 . . . . 0.23 111.681 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.699 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 40.2 p -98.49 -18.76 18.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.865 0.364 . . . . 0.17 111.921 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.53 21.32 60.32 Favored Glycine 0 C--N 1.322 -0.23 0 C-N-CA 121.202 -0.523 . . . . 0.29 112.346 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.8 ' HA2' HD23 ' A' ' 33' ' ' LEU . . . 95.77 16.5 38.94 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 111.047 -0.821 . . . . 0.37 111.047 -178.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 19.7 t70 -90.89 87.73 6.75 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 106.041 -1.837 . . . . 0.64 106.041 175.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.873 HD11 ' HG ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -73.54 -27.11 22.83 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.955 -1.02 . . . . 0.52 113.02 -158.495 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 8.8 p30 -60.97 -43.25 99.05 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.91 -0.774 . . . . 1.29 108.91 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -72.69 -30.6 64.36 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.022 -0.99 . . . . 0.29 110.639 176.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.52 91.53 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.468 -0.333 . . . . 0.24 110.83 172.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 40' ' ' ILE . 3.1 mt -65.98 -38.71 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 N-CA-C 109.356 -0.609 . . . . 0.38 109.356 176.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 41' ' ' ASN . 21.5 mm-40 -58.19 -30.39 66.39 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.505 -0.77 . . . . 2.35 110.41 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 61.3 mtp85 -77.96 -43.73 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.687 0.28 . . . . 2.47 110.742 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.76 -45.09 91.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 0.45 111.493 -177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.572 HD23 HG22 ' A' ' 44' ' ' ILE . 3.0 mm? -72.18 -35.62 69.04 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.359 -0.608 . . . . 1.76 109.359 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' ' 51' ' ' GLN . . . 73.68 74.84 0.79 Allowed Glycine 0 CA--C 1.491 -1.459 0 N-CA-C 109.944 -1.263 . . . . 1.28 109.944 -173.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 p -28.09 97.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 O-C-N 125.52 1.365 . . . . 4.31 112.198 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 45.3 mt-30 -101.73 86.25 2.89 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.828 -1.078 . . . . 5.65 108.238 -178.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.559 ' H ' HD23 ' A' ' 52' ' ' LEU . 1.8 pt? -114.75 73.74 0.84 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.056 -0.974 . . . . 9.0 110.049 -173.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.249 1.067 0 CA-C-N 114.585 -1.188 . . . . 10.04 108.806 178.055 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 111.732 -0.547 . . . . 6.75 111.732 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -66.99 133.92 32.67 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.429 2.086 . . . . 6.37 111.729 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 3' ' ' LEU . 4.7 mp -82.24 100.6 9.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.019 0.437 . . . . 4.58 110.263 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.7 -12.53 78.1 Favored Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.655 -0.783 . . . . 1.5 111.43 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.415 ' C ' ' HD3' ' A' ' 7' ' ' PRO . 4.7 p -87.94 48.68 1.68 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 122.062 0.934 . . . . 1.68 110.084 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.499 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 20.7 mtm -139.23 55.24 7.07 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 114.488 -1.233 . . . . 2.28 108.155 173.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 6' ' ' MET . 68.1 Cg_exo -55.65 -47.25 26.41 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.529 2.152 . . . . 0.92 112.027 -170.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -80.88 13.27 2.74 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.567 -0.453 . . . . 1.2 111.564 -174.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 92.8 t -94.67 -27.95 4.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.25 -0.648 . . . . 0.61 109.25 169.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -103.27 -48.45 4.0 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 122.041 0.924 . . . . 2.74 108.684 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.648 ' HA ' HD22 ' A' ' 33' ' ' LEU . 2.8 m-85 -60.88 -51.42 69.37 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.196 -1.366 . . . . 0.56 110.182 -176.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 7.0 tt0 -58.24 -33.6 69.53 Favored 'General case' 0 C--O 1.222 -0.387 0 O-C-N 123.202 0.314 . . . . 1.26 111.552 -174.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -65.3 -49.5 69.28 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.475 0.655 . . . . 1.19 109.491 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.704 ' HB2' HD21 ' A' ' 33' ' ' LEU . 1.3 mp0 -66.97 -20.74 65.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.508 -0.769 . . . . 1.24 110.728 174.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' A' ' 29' ' ' ASN . 15.5 mt -78.18 -35.6 48.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.102 -0.499 . . . . 0.2 110.907 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.677 ' HG3' ' O ' ' A' ' 12' ' ' GLN . 32.1 mt-10 -64.8 -34.29 78.01 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.78 0.8 . . . . 0.88 108.863 172.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.538 ' O ' ' HG2' ' A' ' 21' ' ' MET . 8.4 tt0 -63.92 -52.74 58.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.734 -1.121 . . . . 0.37 110.877 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.674 ' HA ' ' HG3' ' A' ' 21' ' ' MET . 48.0 mt -64.67 -35.3 80.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.838 0.828 . . . . 0.17 109.128 177.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' A' ' 15' ' ' LEU . 7.6 t30 -53.95 -34.25 59.14 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.969 -1.469 . . . . 0.25 110.371 176.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.5 t -87.06 -14.75 40.6 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.159 -1.382 . . . . 0.66 110.012 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.674 ' HG3' ' HA ' ' A' ' 18' ' ' LEU . 26.0 mmm -82.21 -17.77 44.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.007 -0.997 . . . . 1.41 110.009 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.46 10.84 30.46 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.09 -0.959 . . . . 0.19 110.943 -172.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 50.3 m-85 -103.77 106.15 16.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.382 0.61 . . . . 0.37 110.414 178.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.07 15.87 3.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.701 -0.681 . . . . 0.23 111.469 -177.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 54.6 t30 -84.22 84.19 7.71 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.41 -1.7 . . . . 1.84 106.41 171.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.785 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mmp_? -45.85 -49.62 15.13 Favored 'General case' 0 CA--C 1.507 -0.677 0 O-C-N 123.842 0.714 . . . . 1.63 111.762 -172.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -53.89 -51.23 64.35 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 123.953 0.783 . . . . 2.44 110.931 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.482 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . . . -60.09 -52.66 64.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.689 0.281 . . . . 0.26 110.293 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.799 ' HB3' HD22 ' A' ' 15' ' ' LEU . 4.6 m-20 -48.0 -64.34 0.82 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.46 -0.791 . . . . 0.14 111.568 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' O ' ' A' ' 26' ' ' ARG . 1.7 pp -73.93 -25.04 59.76 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 120.432 -0.507 . . . . 0.27 112.124 -172.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.481 ' N ' HD12 ' A' ' 30' ' ' LEU . 16.5 mt-30 -62.45 -35.64 79.94 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.865 0.841 . . . . 2.18 109.295 174.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.54 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . . . -71.98 -33.08 67.85 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.471 -1.24 . . . . 0.12 108.49 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.704 HD21 ' HB2' ' A' ' 14' ' ' GLN . 1.0 OUTLIER -78.01 -20.04 53.28 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.588 -1.187 . . . . 0.2 111.166 176.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.759 HG13 ' O ' ' A' ' 30' ' ' LEU . 34.6 mt -68.9 -49.08 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 109.053 -0.721 . . . . 0.34 109.053 174.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.03 -20.66 60.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.491 -0.777 . . . . 0.23 112.016 -177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.815 ' HB ' ' HB3' ' A' ' 39' ' ' ASP . 60.8 p -102.43 -18.72 15.24 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.585 -0.446 . . . . 0.17 111.874 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.74 26.13 74.76 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.315 -0.469 . . . . 0.29 113.533 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.99 20.98 8.01 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.398 -0.906 . . . . 0.37 111.729 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.815 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 63.0 t0 -103.9 87.17 2.73 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 106.735 -1.579 . . . . 0.64 106.735 176.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.675 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -65.85 -28.83 45.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-N 113.927 -1.488 . . . . 0.52 111.437 -167.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -61.43 -47.13 87.12 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.59 0.71 . . . . 1.29 109.251 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.662 ' O ' ' HG3' ' A' ' 46' ' ' ARG . . . -75.25 -29.46 60.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.067 -0.97 . . . . 0.29 109.968 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.522 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . . . -54.51 -45.07 73.22 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.24 110.294 171.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 40' ' ' ILE . 0.9 OUTLIER -68.34 -37.85 78.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 109.646 -0.501 . . . . 0.38 109.646 177.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -60.7 -20.09 60.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.892 -0.595 . . . . 2.35 110.688 174.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.662 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 64.1 mtp85 -87.6 -42.42 12.72 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.595 -0.442 . . . . 2.47 110.336 177.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.433 HD11 HD13 ' A' ' 18' ' ' LEU . 79.6 mt -62.72 -46.93 85.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.783 -0.644 . . . . 0.45 110.665 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 mt -75.75 -38.12 58.68 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.601 -0.727 . . . . 1.76 109.95 176.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.782 ' O ' ' HG3' ' A' ' 51' ' ' GLN . . . 87.55 93.24 0.97 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 109.357 -1.497 . . . . 1.28 109.357 -173.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m -28.89 101.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 O-C-N 125.141 1.142 . . . . 4.31 111.995 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.782 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 44.0 mt-30 -114.24 86.89 2.51 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.958 -1.019 . . . . 5.65 108.437 -178.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.415 HD12 ' N ' ' A' ' 52' ' ' LEU . 5.5 mp -110.76 77.11 1.02 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.668 -0.696 . . . . 9.0 109.746 -176.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.396 -0.82 . . . . 10.04 109.523 -179.082 . . . . . . . . 0 0 . 1 stop_ save_